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

Systemtic Name: N-[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-6-oxidanyl-hexyl]-2-(dimethylcarbamoylamino)-3-naphthalen-2-yl-propanamide Openeye Name: N-[5-[(4-aminophenyl)sulfonyl-isobutyl-amino]-6-hydroxy-hexyl]-2-(dimethylcarbamoylamino)-3-(2-naphthyl)propanamide CAS Name: N-[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-6-hydroxyhexyl]-2-[[dimethylamino(oxo)methyl]amino]-3-(2-naphthalenyl)propanamide IUPAC Name: N-[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-6-hydroxyhexyl]-2-(dimethylcarbamoylamino)-3-naphthalen-2-ylpropanamide Traditional Name: 2-(dimethylcarbamoylamino)-N-[6-hydroxy-5-[isobutyl(sulfanilyl)amino]hexyl]-3-(2-naphthyl)propionamide Formula: C32H45N5O5S MolecularWeight: 611.7952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H45N5O5S/c1-23(2)21-37(43(41,42)29-16-14-27(33)15-17-29)28(22-38)11-7-8-18-34-31(39)30(35-32(40)36(3)4)20-24-12-13-25-9-5-6-10-26(25)19-24/h5-6,9-10,12-17,19,23,28,30,38H,7-8,11,18,20-22,33H2,1-4H3,(H,34,39)(H,35,40)