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

Systemtic Name: (2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)propanamide Openeye Name: (2R)-N-benzyl-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-(phenylmethyl)propanamide IUPAC Name: (2R)-N-benzyl-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-benzyl-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)NCC2=CC=CC=C2)C3CC3

Isomeric SMILES

CCN1C(=NN=C1S[C@H](C)C(=O)NCC2=CC=CC=C2)C3CC3

InChI

InChI=1S/C17H22N4OS/c1-3-21-15(14-9-10-14)19-20-17(21)23-12(2)16(22)18-11-13-7-5-4-6-8-13/h4-8,12,14H,3,9-11H2,1-2H3,(H,18,22)/t12-/m1/s1