N-cyclopropyl-3-[4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanoylamino]benzamide

Systemtic Name: N-cyclopropyl-3-[4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanoylamino]benzamide Openeye Name: 3-[4-[(4-acetylphenyl)sulfonyl-methyl-amino]butanoylamino]-N-cyclopropyl-benzamide CAS Name: 3-[[4-[(4-acetylphenyl)sulfonyl-methylamino]-1-oxobutyl]amino]-N-cyclopropylbenzamide IUPAC Name: 3-[4-[(4-acetylphenyl)sulfonyl-methylamino]butanoylamino]-N-cyclopropylbenzamide Traditional Name: 3-[4-[(4-acetylphenyl)sulfonyl-methyl-amino]butanoylamino]-N-cyclopropyl-benzamide Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CCCC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CCCC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3

InChI

InChI=1S/C23H27N3O5S/c1-16(27)17-8-12-21(13-9-17)32(30,31)26(2)14-4-7-22(28)24-20-6-3-5-18(15-20)23(29)25-19-10-11-19/h3,5-6,8-9,12-13,15,19H,4,7,10-11,14H2,1-2H3,(H,24,28)(H,25,29)