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

Systemtic Name: 4-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)-N-(3,4,5-trimethoxyphenyl)piperidine-1-carbothioamide Openeye Name: 4-[5-(2-thienyl)tetrazol-2-yl]-N-(3,4,5-trimethoxyphenyl)piperidine-1-carbothioamide CAS Name: 4-(5-thiophen-2-yl-2-tetrazolyl)-N-(3,4,5-trimethoxyphenyl)-1-piperidinecarbothioamide IUPAC Name: 4-(5-thiophen-2-yltetrazol-2-yl)-N-(3,4,5-trimethoxyphenyl)piperidine-1-carbothioamide Traditional Name: 4-[5-(2-thienyl)tetrazol-2-yl]-N-(3,4,5-trimethoxyphenyl)piperidine-1-carbothioamide Formula: C20H24N6O3S2 MolecularWeight: 460.57296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=S)N2CCC(CC2)N3N=C(N=N3)C4=CC=CS4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=S)N2CCC(CC2)N3N=C(N=N3)C4=CC=CS4

InChI

InChI=1S/C20H24N6O3S2/c1-27-15-11-13(12-16(28-2)18(15)29-3)21-20(30)25-8-6-14(7-9-25)26-23-19(22-24-26)17-5-4-10-31-17/h4-5,10-12,14H,6-9H2,1-3H3,(H,21,30)