N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-[4-(4-ethoxyphenyl)thiazol-2-yl]-2-[2-(3-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-[4-(4-ethoxyphenyl)-2-thiazolyl]-2-[[2-(3-methyl-1-piperidinyl)-2-oxoethyl]thio]acetamide IUPAC Name: N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanylacetamide Traditional Name: 2-[[2-keto-2-(3-methylpiperidino)ethyl]thio]-N-(4-p-phenetylthiazol-2-yl)acetamide Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSCC(=O)N3CCCC(C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSCC(=O)N3CCCC(C3)C

InChI

InChI=1S/C21H27N3O3S2/c1-3-27-17-8-6-16(7-9-17)18-12-29-21(22-18)23-19(25)13-28-14-20(26)24-10-4-5-15(2)11-24/h6-9,12,15H,3-5,10-11,13-14H2,1-2H3,(H,22,23,25)