N-ethyl-3-[2-[methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]amino]ethanoylamino]benzamide

Systemtic Name: N-ethyl-3-[2-[methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]amino]ethanoylamino]benzamide Openeye Name: N-ethyl-3-[[2-[methyl-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]amino]acetyl]amino]benzamide CAS Name: N-ethyl-3-[[2-[methyl-[2-[2-(methylthio)anilino]-2-oxoethyl]amino]-1-oxoethyl]amino]benzamide IUPAC Name: N-ethyl-3-[[2-[methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]amino]acetyl]amino]benzamide Traditional Name: N-ethyl-3-[[2-[[2-keto-2-[2-(methylthio)anilino]ethyl]-methyl-amino]acetyl]amino]benzamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC(=O)CN(C)CC(=O)NC2=CC=CC=C2SC

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=O)CN(C)CC(=O)NC2=CC=CC=C2SC

InChI

InChI=1S/C21H26N4O3S/c1-4-22-21(28)15-8-7-9-16(12-15)23-19(26)13-25(2)14-20(27)24-17-10-5-6-11-18(17)29-3/h5-12H,4,13-14H2,1-3H3,(H,22,28)(H,23,26)(H,24,27)