N-cyclopropyl-3-[2-[[(E)-2-phenylethenyl]sulfonyl-(phenylmethyl)amino]ethanoylamino]benzamide

Systemtic Name: N-cyclopropyl-3-[2-[[(E)-2-phenylethenyl]sulfonyl-(phenylmethyl)amino]ethanoylamino]benzamide Openeye Name: 3-[[2-[benzyl-[(E)-styryl]sulfonyl-amino]acetyl]amino]-N-cyclopropyl-benzamide CAS Name: N-cyclopropyl-3-[[1-oxo-2-[[(E)-2-phenylethenyl]sulfonyl-(phenylmethyl)amino]ethyl]amino]benzamide IUPAC Name: 3-[[2-[benzyl-[(E)-2-phenylethenyl]sulfonylamino]acetyl]amino]-N-cyclopropylbenzamide Traditional Name: 3-[[2-[benzyl-[(E)-styryl]sulfonyl-amino]acetyl]amino]-N-cyclopropyl-benzamide Formula: C27H27N3O4S MolecularWeight: 489.58598

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)CN(CC3=CC=CC=C3)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)CN(CC3=CC=CC=C3)S(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O4S/c31-26(28-25-13-7-12-23(18-25)27(32)29-24-14-15-24)20-30(19-22-10-5-2-6-11-22)35(33,34)17-16-21-8-3-1-4-9-21/h1-13,16-18,24H,14-15,19-20H2,(H,28,31)(H,29,32)/b17-16+