methyl 2-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-6-azanyl-hexanoate

Systemtic Name: methyl 2-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-6-azanyl-hexanoate Openeye Name: methyl 6-amino-2-[(4-aminophenyl)sulfonyl-isobutyl-amino]hexanoate CAS Name: 6-amino-2-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]hexanoic acid methyl ester IUPAC Name: methyl 6-amino-2-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]hexanoate Traditional Name: 6-amino-2-[isobutyl(sulfanilyl)amino]hexanoic acid methyl ester Formula: C17H29N3O4S MolecularWeight: 371.49486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C(CCCCN)C(=O)OC)S(=O)(=O)C1=CC=C(C=C1)N

Isomeric SMILES

CC(C)CN(C(CCCCN)C(=O)OC)S(=O)(=O)C1=CC=C(C=C1)N

InChI

InChI=1S/C17H29N3O4S/c1-13(2)12-20(16(17(21)24-3)6-4-5-11-18)25(22,23)15-9-7-14(19)8-10-15/h7-10,13,16H,4-6,11-12,18-19H2,1-3H3