2-[(4-acetamidophenyl)sulfonyl-propan-2-yl-amino]-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-ethanamide

Systemtic Name: 2-[(4-acetamidophenyl)sulfonyl-propan-2-yl-amino]-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-ethanamide Openeye Name: 2-[(4-acetamidophenyl)sulfonyl-isopropyl-amino]-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-acetamide CAS Name: 2-[(4-acetamidophenyl)sulfonyl-propan-2-ylamino]-N-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl]-N-butylacetamide IUPAC Name: 2-[(4-acetamidophenyl)sulfonyl-propan-2-ylamino]-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butylacetamide Traditional Name: 2-[(4-acetamidophenyl)sulfonyl-isopropyl-amino]-N-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl]-N-butyl-acetamide Formula: C29H37BrN4O4S MolecularWeight: 617.59748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)CN(C(C)C)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)CN(C(C)C)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C29H37BrN4O4S/c1-5-6-17-33(20-27-8-7-18-32(27)19-24-9-11-25(30)12-10-24)29(36)21-34(22(2)3)39(37,38)28-15-13-26(14-16-28)31-23(4)35/h7-16,18,22H,5-6,17,19-21H2,1-4H3,(H,31,35)