4-[(2,3-dimethylphenyl)carbamothioyl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[(2,3-dimethylphenyl)carbamothioyl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[(2,3-dimethylphenyl)carbamothioyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[(2,3-dimethylanilino)-sulfanylidenemethyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[(2,3-dimethylphenyl)carbamothioyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[(2,3-dimethylphenyl)thiocarbamoyl]-N-phenyl-piperazine-1-carboxamide Formula: C20H24N4OS MolecularWeight: 368.49576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)N2CCN(CC2)C(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)N2CCN(CC2)C(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C20H24N4OS/c1-15-7-6-10-18(16(15)2)22-20(26)24-13-11-23(12-14-24)19(25)21-17-8-4-3-5-9-17/h3-10H,11-14H2,1-2H3,(H,21,25)(H,22,26)