N-(5-chloranyl-2-methoxy-phenyl)-4-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)piperidine-1-carbothioamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-4-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)piperidine-1-carbothioamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-4-[5-(2-thienyl)tetrazol-2-yl]piperidine-1-carbothioamide CAS Name: N-(5-chloro-2-methoxyphenyl)-4-(5-thiophen-2-yl-2-tetrazolyl)-1-piperidinecarbothioamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-4-(5-thiophen-2-yltetrazol-2-yl)piperidine-1-carbothioamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-4-[5-(2-thienyl)tetrazol-2-yl]piperidine-1-carbothioamide Formula: C18H19ClN6OS2 MolecularWeight: 434.96606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClN6OS2/c1-26-15-5-4-12(19)11-14(15)20-18(27)24-8-6-13(7-9-24)25-22-17(21-23-25)16-3-2-10-28-16/h2-5,10-11,13H,6-9H2,1H3,(H,20,27)