N-cyclopropyl-3-[[2-[(4-ethoxyphenyl)sulfonylamino]-4-methylsulfanyl-butanoyl]amino]benzamide

Systemtic Name: N-cyclopropyl-3-[[2-[(4-ethoxyphenyl)sulfonylamino]-4-methylsulfanyl-butanoyl]amino]benzamide Openeye Name: N-cyclopropyl-3-[[2-[(4-ethoxyphenyl)sulfonylamino]-4-methylsulfanyl-butanoyl]amino]benzamide CAS Name: N-cyclopropyl-3-[[2-[(4-ethoxyphenyl)sulfonylamino]-4-(methylthio)-1-oxobutyl]amino]benzamide IUPAC Name: N-cyclopropyl-3-[[2-[(4-ethoxyphenyl)sulfonylamino]-4-methylsulfanylbutanoyl]amino]benzamide Traditional Name: N-cyclopropyl-3-[[4-(methylthio)-2-(p-phenetylsulfonylamino)butanoyl]amino]benzamide Formula: C23H29N3O5S2 MolecularWeight: 491.62346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NC2=CC=CC(=C2)C(=O)NC3CC3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NC2=CC=CC(=C2)C(=O)NC3CC3

InChI

InChI=1S/C23H29N3O5S2/c1-3-31-19-9-11-20(12-10-19)33(29,30)26-21(13-14-32-2)23(28)25-18-6-4-5-16(15-18)22(27)24-17-7-8-17/h4-6,9-12,15,17,21,26H,3,7-8,13-14H2,1-2H3,(H,24,27)(H,25,28)