N-(2,5-dimethylpyrrol-1-yl)-4-[2-[(4-methylsulfanylphenyl)amino]-2-oxidanylidene-ethoxy]benzamide

Systemtic Name: N-(2,5-dimethylpyrrol-1-yl)-4-[2-[(4-methylsulfanylphenyl)amino]-2-oxidanylidene-ethoxy]benzamide Openeye Name: N-(2,5-dimethylpyrrol-1-yl)-4-[2-(4-methylsulfanylanilino)-2-oxo-ethoxy]benzamide CAS Name: N-(2,5-dimethyl-1-pyrrolyl)-4-[2-[4-(methylthio)anilino]-2-oxoethoxy]benzamide IUPAC Name: N-(2,5-dimethylpyrrol-1-yl)-4-[2-(4-methylsulfanylanilino)-2-oxoethoxy]benzamide Traditional Name: N-(2,5-dimethylpyrrol-1-yl)-4-[2-keto-2-[4-(methylthio)anilino]ethoxy]benzamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1NC(=O)C2=CC=C(C=C2)OCC(=O)NC3=CC=C(C=C3)SC)C

Isomeric SMILES

CC1=CC=C(N1NC(=O)C2=CC=C(C=C2)OCC(=O)NC3=CC=C(C=C3)SC)C

InChI

InChI=1S/C22H23N3O3S/c1-15-4-5-16(2)25(15)24-22(27)17-6-10-19(11-7-17)28-14-21(26)23-18-8-12-20(29-3)13-9-18/h4-13H,14H2,1-3H3,(H,23,26)(H,24,27)