N-[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-6-oxidanyl-hexyl]-2-(butylamino)-3-naphthalen-2-yl-propanamide

Systemtic Name: N-[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-6-oxidanyl-hexyl]-2-(butylamino)-3-naphthalen-2-yl-propanamide Openeye Name: N-[5-[(4-aminophenyl)sulfonyl-isobutyl-amino]-6-hydroxy-hexyl]-2-(butylamino)-3-(2-naphthyl)propanamide CAS Name: N-[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-6-hydroxyhexyl]-2-(butylamino)-3-(2-naphthalenyl)propanamide IUPAC Name: N-[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-6-hydroxyhexyl]-2-(butylamino)-3-naphthalen-2-ylpropanamide Traditional Name: 2-(butylamino)-N-[6-hydroxy-5-[isobutyl(sulfanilyl)amino]hexyl]-3-(2-naphthyl)propionamide Formula: C33H48N4O4S MolecularWeight: 596.82362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(CC1=CC2=CC=CC=C2C=C1)C(=O)NCCCCC(CO)N(CC(C)C)S(=O)(=O)C3=CC=C(C=C3)N

Isomeric SMILES

CCCCNC(CC1=CC2=CC=CC=C2C=C1)C(=O)NCCCCC(CO)N(CC(C)C)S(=O)(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C33H48N4O4S/c1-4-5-19-35-32(22-26-13-14-27-10-6-7-11-28(27)21-26)33(39)36-20-9-8-12-30(24-38)37(23-25(2)3)42(40,41)31-17-15-29(34)16-18-31/h6-7,10-11,13-18,21,25,30,32,35,38H,4-5,8-9,12,19-20,22-24,34H2,1-3H3,(H,36,39)