N-[4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-5-oxidanyl-pentyl]-2-azanyl-3-(2-phenylphenyl)propanamide

Systemtic Name: N-[4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-5-oxidanyl-pentyl]-2-azanyl-3-(2-phenylphenyl)propanamide Openeye Name: 2-amino-N-[4-[(4-aminophenyl)sulfonyl-isobutyl-amino]-5-hydroxy-pentyl]-3-(2-phenylphenyl)propanamide CAS Name: 2-amino-N-[4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-5-hydroxypentyl]-3-(2-phenylphenyl)propanamide IUPAC Name: 2-amino-N-[4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-5-hydroxypentyl]-3-(2-phenylphenyl)propanamide Traditional Name: 2-amino-N-[5-hydroxy-4-[isobutyl(sulfanilyl)amino]pentyl]-3-(2-phenylphenyl)propionamide Formula: C30H40N4O4S MolecularWeight: 552.728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C(CCCNC(=O)C(CC1=CC=CC=C1C2=CC=CC=C2)N)CO)S(=O)(=O)C3=CC=C(C=C3)N

Isomeric SMILES

CC(C)CN(C(CCCNC(=O)C(CC1=CC=CC=C1C2=CC=CC=C2)N)CO)S(=O)(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C30H40N4O4S/c1-22(2)20-34(39(37,38)27-16-14-25(31)15-17-27)26(21-35)12-8-18-33-30(36)29(32)19-24-11-6-7-13-28(24)23-9-4-3-5-10-23/h3-7,9-11,13-17,22,26,29,35H,8,12,18-21,31-32H2,1-2H3,(H,33,36)