2-[3-[3-[(2-aminocarbonylphenyl)amino]-3-oxidanylidene-propyl]sulfanylpropanoylamino]benzamide

Systemtic Name: 2-[3-[3-[(2-aminocarbonylphenyl)amino]-3-oxidanylidene-propyl]sulfanylpropanoylamino]benzamide Openeye Name: 2-[3-[3-(2-carbamoylanilino)-3-oxo-propyl]sulfanylpropanoylamino]benzamide CAS Name: 2-[[3-[[3-(2-carbamoylanilino)-3-oxopropyl]thio]-1-oxopropyl]amino]benzamide IUPAC Name: 2-[3-[3-(2-carbamoylanilino)-3-oxopropyl]sulfanylpropanoylamino]benzamide Traditional Name: 2-[3-[[3-(2-carbamoylanilino)-3-keto-propyl]thio]propanoylamino]benzamide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)N)NC(=O)CCSCCC(=O)NC2=CC=CC=C2C(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N)NC(=O)CCSCCC(=O)NC2=CC=CC=C2C(=O)N

InChI

InChI=1S/C20H22N4O4S/c21-19(27)13-5-1-3-7-15(13)23-17(25)9-11-29-12-10-18(26)24-16-8-4-2-6-14(16)20(22)28/h1-8H,9-12H2,(H2,21,27)(H2,22,28)(H,23,25)(H,24,26)