4-ethyl-N-[[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]benzamide

Systemtic Name: 4-ethyl-N-[[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]benzamide Openeye Name: 4-ethyl-N-[[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]benzamide CAS Name: 4-ethyl-N-[[4-(4-methyl-1-piperazinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-ethyl-N-[[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]benzamide Traditional Name: 4-ethyl-N-[[4-(4-methylpiperazino)phenyl]thiocarbamoyl]benzamide Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCN(CC3)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCN(CC3)C

InChI

InChI=1S/C21H26N4OS/c1-3-16-4-6-17(7-5-16)20(26)23-21(27)22-18-8-10-19(11-9-18)25-14-12-24(2)13-15-25/h4-11H,3,12-15H2,1-2H3,(H2,22,23,26,27)