3-(4-methoxyphenyl)-N-[[2-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]prop-2-enamide

Systemtic Name: 3-(4-methoxyphenyl)-N-[[2-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]prop-2-enamide Openeye Name: 3-(4-methoxyphenyl)-N-[[2-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]prop-2-enamide CAS Name: 3-(4-methoxyphenyl)-N-[[2-(4-methyl-1-piperazinyl)anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: 3-(4-methoxyphenyl)-N-[[2-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]prop-2-enamide Traditional Name: 3-(4-methoxyphenyl)-N-[[2-(4-methylpiperazino)phenyl]thiocarbamoyl]acrylamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC=C2NC(=S)NC(=O)C=CC3=CC=C(C=C3)OC

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC=C2NC(=S)NC(=O)C=CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H26N4O2S/c1-25-13-15-26(16-14-25)20-6-4-3-5-19(20)23-22(29)24-21(27)12-9-17-7-10-18(28-2)11-8-17/h3-12H,13-16H2,1-2H3,(H2,23,24,27,29)