4-(1,3-benzothiazol-2-ylmethyl)-N-(2-methylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-(2-methylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-(o-tolyl)piperazine-1-carbothioamide CAS Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-(2-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-(2-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-(o-tolyl)piperazine-1-carbothioamide Formula: C20H22N4S2 MolecularWeight: 382.54548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N2CCN(CC2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N2CCN(CC2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H22N4S2/c1-15-6-2-3-7-16(15)22-20(25)24-12-10-23(11-13-24)14-19-21-17-8-4-5-9-18(17)26-19/h2-9H,10-14H2,1H3,(H,22,25)