4-(1,2-benzothiazol-3-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(1,2-benzothiazol-3-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(1,2-benzothiazol-3-yl)-N-(4-isopropylphenyl)piperazine-1-carbothioamide CAS Name: 4-(1,2-benzothiazol-3-yl)-N-(4-propan-2-ylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(1,2-benzothiazol-3-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(1,2-benzothiazol-3-yl)-N-p-cumenyl-piperazine-1-carbothioamide Formula: C21H24N4S2 MolecularWeight: 396.57206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=NSC4=CC=CC=C43

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C21H24N4S2/c1-15(2)16-7-9-17(10-8-16)22-21(26)25-13-11-24(12-14-25)20-18-5-3-4-6-19(18)27-23-20/h3-10,15H,11-14H2,1-2H3,(H,22,26)