4-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(3,4-dimethoxyphenyl)-1,3-thiazole

Systemtic Name: 4-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(3,4-dimethoxyphenyl)-1,3-thiazole Openeye Name: 4-[[4-cyclopropyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2-(3,4-dimethoxyphenyl)thiazole CAS Name: 4-[[[4-cyclopropyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]methyl]-2-(3,4-dimethoxyphenyl)thiazole IUPAC Name: 4-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(3,4-dimethoxyphenyl)-1,3-thiazole Traditional Name: 4-[[(4-cyclopropyl-5-piperidino-1,2,4-triazol-3-yl)thio]methyl]-2-(3,4-dimethoxyphenyl)thiazole Formula: C22H27N5O2S2 MolecularWeight: 457.61208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)CSC3=NN=C(N3C4CC4)N5CCCCC5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)CSC3=NN=C(N3C4CC4)N5CCCCC5)OC

InChI

InChI=1S/C22H27N5O2S2/c1-28-18-9-6-15(12-19(18)29-2)20-23-16(13-30-20)14-31-22-25-24-21(27(22)17-7-8-17)26-10-4-3-5-11-26/h6,9,12-13,17H,3-5,7-8,10-11,14H2,1-2H3