N-(1-methylpyrazol-3-yl)-4-phenyl-piperazine-1-carbothioamide

Systemtic Name: N-(1-methylpyrazol-3-yl)-4-phenyl-piperazine-1-carbothioamide Openeye Name: N-(1-methylpyrazol-3-yl)-4-phenyl-piperazine-1-carbothioamide CAS Name: N-(1-methyl-3-pyrazolyl)-4-phenyl-1-piperazinecarbothioamide IUPAC Name: N-(1-methylpyrazol-3-yl)-4-phenylpiperazine-1-carbothioamide Traditional Name: N-(1-methylpyrazol-3-yl)-4-phenyl-piperazine-1-carbothioamide Formula: C15H19N5S MolecularWeight: 301.40986

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=S)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CN1C=CC(=N1)NC(=S)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C15H19N5S/c1-18-8-7-14(17-18)16-15(21)20-11-9-19(10-12-20)13-5-3-2-4-6-13/h2-8H,9-12H2,1H3,(H,16,17,21)