(2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-methoxyphenyl)propan-1-one

Systemtic Name: (2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-methoxyphenyl)propan-1-one Openeye Name: (2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-methoxyphenyl)propan-1-one CAS Name: (2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-1-(4-methoxyphenyl)-1-propanone IUPAC Name: (2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-methoxyphenyl)propan-1-one Traditional Name: (2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-1-(4-methoxyphenyl)propan-1-one Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)C2=CC=C(C=C2)OC)C3CC3

Isomeric SMILES

CCN1C(=NN=C1S[C@H](C)C(=O)C2=CC=C(C=C2)OC)C3CC3

InChI

InChI=1S/C17H21N3O2S/c1-4-20-16(13-5-6-13)18-19-17(20)23-11(2)15(21)12-7-9-14(22-3)10-8-12/h7-11,13H,4-6H2,1-3H3/t11-/m1/s1