4-Amino-N-[(1-Benzyl-2-Pyrrolidinyl)Methyl]-5-(Ethylsulphonyl)-2-Methoxybenzamide
[CAS# 93839-84-0]

Identification

• Name: 4-Amino-N-[(1-Benzyl-2-Pyrrolidinyl)Methyl]-5-(Ethylsulphonyl)-2-Methoxybenzamide
• Synonyms: 4-Amino-5-Ethylsulfonyl-2-Methoxy-N-[[1-(Phenylmethyl)-2-Pyrrolidinyl]Methyl]Benzamide; 4-Amino-N-[[1-(Benzyl)Pyrrolidin-2-Yl]Methyl]-5-Ethylsulfonyl-2-Methoxy-Benzamide; 4-Amino-N-((1-Benzyl-2-Pyrrolidinyl)Methyl)-5-(Ethylsulphonyl)-2-Methoxybenzamide
• Molecular Formula: C₂₂H₂₉N₃O₄S
• Molecular Weight: 431.55
• CAS Registry Number: 93839-84-0
• EINECS: 298-857-0
• SMILES: C1=C(N)C(=CC(=C1OC)C(=O)NCC3N(CC2=CC=CC=C2)CCC3)[S](=O)(=O)CC
• InChI: 1S/C22H29N3O4S/c1-3-30(27,28)21-12-18(20(29-2)13-19(21)23)22(26)24-14-17-10-7-11-25(17)15-16-8-5-4-6-9-16/h4-6,8-9,12-13,17H,3,7,10-11,14-15,23H2,1-2H3,(H,24,26)
• InChIKey: MCHCXHUXQSAMCF-UHFFFAOYSA-N

Properties

• Density: 1.238g/cm³ (Cal.)
• Boiling point: 622.129°C at 760 mmHg (Cal.)
• Flash point: 330.052°C (Cal.)