(2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethanoylphenyl)propanamide

Systemtic Name: (2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethanoylphenyl)propanamide Openeye Name: (2R)-N-(2-acetylphenyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2R)-N-(2-acetylphenyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2R)-N-(2-acetylphenyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-(2-acetylphenyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)NC2=CC=CC=C2C(=O)C)C3CC3

Isomeric SMILES

CCN1C(=NN=C1S[C@H](C)C(=O)NC2=CC=CC=C2C(=O)C)C3CC3

InChI

InChI=1S/C18H22N4O2S/c1-4-22-16(13-9-10-13)20-21-18(22)25-12(3)17(24)19-15-8-6-5-7-14(15)11(2)23/h5-8,12-13H,4,9-10H2,1-3H3,(H,19,24)/t12-/m1/s1