4-[(1,3-dimethylpyrazol-4-yl)methyl]-N-(4-methoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[(1,3-dimethylpyrazol-4-yl)methyl]-N-(4-methoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-[(1,3-dimethylpyrazol-4-yl)methyl]-N-(4-methoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-[(1,3-dimethyl-4-pyrazolyl)methyl]-N-(4-methoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(1,3-dimethylpyrazol-4-yl)methyl]-N-(4-methoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-[(1,3-dimethylpyrazol-4-yl)methyl]-N-(4-methoxyphenyl)piperazine-1-carbothioamide Formula: C18H25N5OS MolecularWeight: 359.489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CN2CCN(CC2)C(=S)NC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=NN(C=C1CN2CCN(CC2)C(=S)NC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C18H25N5OS/c1-14-15(12-21(2)20-14)13-22-8-10-23(11-9-22)18(25)19-16-4-6-17(24-3)7-5-16/h4-7,12H,8-11,13H2,1-3H3,(H,19,25)