4-cyclopropylcarbonyl-N-(3,4-dimethylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-cyclopropylcarbonyl-N-(3,4-dimethylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(cyclopropanecarbonyl)-N-(3,4-dimethylphenyl)piperazine-1-carbothioamide CAS Name: 4-[cyclopropyl(oxo)methyl]-N-(3,4-dimethylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(cyclopropanecarbonyl)-N-(3,4-dimethylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(cyclopropanecarbonyl)-N-(3,4-dimethylphenyl)piperazine-1-carbothioamide Formula: C17H23N3OS MolecularWeight: 317.44902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3CC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3CC3)C

InChI

InChI=1S/C17H23N3OS/c1-12-3-6-15(11-13(12)2)18-17(22)20-9-7-19(8-10-20)16(21)14-4-5-14/h3,6,11,14H,4-5,7-10H2,1-2H3,(H,18,22)