N-butyl-2-[2-[(3,4-dimethoxyphenyl)-(phenylsulfonyl)amino]ethanoylamino]benzamide

Systemtic Name: N-butyl-2-[2-[(3,4-dimethoxyphenyl)-(phenylsulfonyl)amino]ethanoylamino]benzamide Openeye Name: 2-[[2-[N-(benzenesulfonyl)-3,4-dimethoxy-anilino]acetyl]amino]-N-butyl-benzamide CAS Name: 2-[[2-[N-(benzenesulfonyl)-3,4-dimethoxyanilino]-1-oxoethyl]amino]-N-butylbenzamide IUPAC Name: 2-[[2-[N-(benzenesulfonyl)-3,4-dimethoxyanilino]acetyl]amino]-N-butylbenzamide Traditional Name: 2-[[2-(N-besyl-3,4-dimethoxy-anilino)acetyl]amino]-N-butyl-benzamide Formula: C27H31N3O6S MolecularWeight: 525.61654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC(=C(C=C2)OC)OC)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC(=C(C=C2)OC)OC)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H31N3O6S/c1-4-5-17-28-27(32)22-13-9-10-14-23(22)29-26(31)19-30(37(33,34)21-11-7-6-8-12-21)20-15-16-24(35-2)25(18-20)36-3/h6-16,18H,4-5,17,19H2,1-3H3,(H,28,32)(H,29,31)