N-(2,6-dimethylphenyl)-2-[4-[(3,4-dimethylphenyl)carbamothioyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-[(3,4-dimethylphenyl)carbamothioyl]piperazin-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-[(3,4-dimethylphenyl)carbamothioyl]piperazin-1-yl]acetamide CAS Name: 2-[4-[(3,4-dimethylanilino)-sulfanylidenemethyl]-1-piperazinyl]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-[(3,4-dimethylphenyl)carbamothioyl]piperazin-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-[(3,4-dimethylphenyl)thiocarbamoyl]piperazino]acetamide Formula: C23H30N4OS MolecularWeight: 410.5755

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=S)NC3=CC(=C(C=C3)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=S)NC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C23H30N4OS/c1-16-8-9-20(14-19(16)4)24-23(29)27-12-10-26(11-13-27)15-21(28)25-22-17(2)6-5-7-18(22)3/h5-9,14H,10-13,15H2,1-4H3,(H,24,29)(H,25,28)