2-[1-[2-(4-methylsulfanylphenyl)ethanoyl]piperidin-4-yl]-N-(1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[1-[2-(4-methylsulfanylphenyl)ethanoyl]piperidin-4-yl]-N-(1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-[2-(4-methylsulfanylphenyl)acetyl]-4-piperidyl]-N-thiazol-2-yl-thiazole-4-carboxamide CAS Name: 2-[1-[2-[4-(methylthio)phenyl]-1-oxoethyl]-4-piperidinyl]-N-(2-thiazolyl)-4-thiazolecarboxamide IUPAC Name: 2-[1-[2-(4-methylsulfanylphenyl)acetyl]piperidin-4-yl]-N-(1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-[2-[4-(methylthio)phenyl]acetyl]-4-piperidyl]-N-thiazol-2-yl-thiazole-4-carboxamide Formula: C21H22N4O2S3 MolecularWeight: 458.61998

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CC(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NC4=NC=CS4

Isomeric SMILES

CSC1=CC=C(C=C1)CC(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NC4=NC=CS4

InChI

InChI=1S/C21H22N4O2S3/c1-28-16-4-2-14(3-5-16)12-18(26)25-9-6-15(7-10-25)20-23-17(13-30-20)19(27)24-21-22-8-11-29-21/h2-5,8,11,13,15H,6-7,9-10,12H2,1H3,(H,22,24,27)