N-cyclopropyl-4-[5-(3,4-dimethoxyphenyl)-1,2,3,4-tetrazol-2-yl]piperidine-1-carbothioamide

Systemtic Name: N-cyclopropyl-4-[5-(3,4-dimethoxyphenyl)-1,2,3,4-tetrazol-2-yl]piperidine-1-carbothioamide Openeye Name: N-cyclopropyl-4-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]piperidine-1-carbothioamide CAS Name: N-cyclopropyl-4-[5-(3,4-dimethoxyphenyl)-2-tetrazolyl]-1-piperidinecarbothioamide IUPAC Name: N-cyclopropyl-4-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]piperidine-1-carbothioamide Traditional Name: N-cyclopropyl-4-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]piperidine-1-carbothioamide Formula: C18H24N6O2S MolecularWeight: 388.48716

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(N=N2)C3CCN(CC3)C(=S)NC4CC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(N=N2)C3CCN(CC3)C(=S)NC4CC4)OC

InChI

InChI=1S/C18H24N6O2S/c1-25-15-6-3-12(11-16(15)26-2)17-20-22-24(21-17)14-7-9-23(10-8-14)18(27)19-13-4-5-13/h3,6,11,13-14H,4-5,7-10H2,1-2H3,(H,19,27)