4-methyl-N-(4-phenethylpiperazin-1-yl)carbothioyl-benzamide

Systemtic Name: 4-methyl-N-(4-phenethylpiperazin-1-yl)carbothioyl-benzamide Openeye Name: 4-methyl-N-(4-phenethylpiperazine-1-carbothioyl)benzamide CAS Name: 4-methyl-N-[(4-phenethyl-1-piperazinyl)-sulfanylidenemethyl]benzamide IUPAC Name: 4-methyl-N-(4-phenethylpiperazine-1-carbothioyl)benzamide Traditional Name: 4-methyl-N-(4-phenethylpiperazine-1-carbothioyl)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)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)N2CCN(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C21H25N3OS/c1-17-7-9-19(10-8-17)20(25)22-21(26)24-15-13-23(14-16-24)12-11-18-5-3-2-4-6-18/h2-10H,11-16H2,1H3,(H,22,25,26)