N-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]-2-methyl-benzamide

Systemtic Name: N-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]-2-methyl-benzamide Openeye Name: N-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]-2-methyl-benzamide CAS Name: N-[[4-(4-ethyl-1-piperazinyl)anilino]-sulfanylidenemethyl]-2-methylbenzamide IUPAC Name: N-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]-2-methylbenzamide Traditional Name: N-[[4-(4-ethylpiperazino)phenyl]thiocarbamoyl]-2-methyl-benzamide Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3C

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3C

InChI

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