N-(3,5-dimethoxyphenyl)-4-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)piperidine-1-carbothioamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-4-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)piperidine-1-carbothioamide Openeye Name: N-(3,5-dimethoxyphenyl)-4-[5-(2-thienyl)tetrazol-2-yl]piperidine-1-carbothioamide CAS Name: N-(3,5-dimethoxyphenyl)-4-(5-thiophen-2-yl-2-tetrazolyl)-1-piperidinecarbothioamide IUPAC Name: N-(3,5-dimethoxyphenyl)-4-(5-thiophen-2-yltetrazol-2-yl)piperidine-1-carbothioamide Traditional Name: N-(3,5-dimethoxyphenyl)-4-[5-(2-thienyl)tetrazol-2-yl]piperidine-1-carbothioamide Formula: C19H22N6O2S2 MolecularWeight: 430.54698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=S)N2CCC(CC2)N3N=C(N=N3)C4=CC=CS4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=S)N2CCC(CC2)N3N=C(N=N3)C4=CC=CS4)OC

InChI

InChI=1S/C19H22N6O2S2/c1-26-15-10-13(11-16(12-15)27-2)20-19(28)24-7-5-14(6-8-24)25-22-18(21-23-25)17-4-3-9-29-17/h3-4,9-12,14H,5-8H2,1-2H3,(H,20,28)