(2S)-N-(4-ethoxyphenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2S)-N-(4-ethoxyphenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2S)-N-(4-ethoxyphenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2S)-N-(4-ethoxyphenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2S)-N-(4-ethoxyphenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2S)-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]-N-p-phenetyl-propionamide Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(C)SC2=NN(C=N2)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)[C@H](C)SC2=NN(C=N2)C3=CC=CC=C3

InChI

InChI=1S/C19H20N4O2S/c1-3-25-17-11-9-15(10-12-17)21-18(24)14(2)26-19-20-13-23(22-19)16-7-5-4-6-8-16/h4-14H,3H2,1-2H3,(H,21,24)/t14-/m0/s1