N-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbothioyl-4-methyl-benzamide

Systemtic Name: N-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbothioyl-4-methyl-benzamide Openeye Name: N-[4-(2,5-dimethylphenyl)piperazine-1-carbothioyl]-4-methyl-benzamide CAS Name: N-[[4-(2,5-dimethylphenyl)-1-piperazinyl]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: N-[4-(2,5-dimethylphenyl)piperazine-1-carbothioyl]-4-methylbenzamide Traditional Name: N-[4-(2,5-dimethylphenyl)piperazine-1-carbothioyl]-4-methyl-benzamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3OS/c1-15-5-8-18(9-6-15)20(25)22-21(26)24-12-10-23(11-13-24)19-14-16(2)4-7-17(19)3/h4-9,14H,10-13H2,1-3H3,(H,22,25,26)