N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-3-phenylsulfanyl-propanamide

Systemtic Name: N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-3-phenylsulfanyl-propanamide Openeye Name: N-[4-(4-ethoxyphenyl)-5-methyl-thiazol-2-yl]-3-phenylsulfanyl-propanamide CAS Name: N-[4-(4-ethoxyphenyl)-5-methyl-2-thiazolyl]-3-(phenylthio)propanamide IUPAC Name: N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-3-phenylsulfanylpropanamide Traditional Name: N-(5-methyl-4-p-phenetyl-thiazol-2-yl)-3-(phenylthio)propionamide Formula: C21H22N2O2S2 MolecularWeight: 398.54158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)CCSC3=CC=CC=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)CCSC3=CC=CC=C3)C

InChI

InChI=1S/C21H22N2O2S2/c1-3-25-17-11-9-16(10-12-17)20-15(2)27-21(23-20)22-19(24)13-14-26-18-7-5-4-6-8-18/h4-12H,3,13-14H2,1-2H3,(H,22,23,24)