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

Systemtic Name: (2R)-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)propanamide Openeye Name: (2R)-N-benzyl-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2R)-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(phenylmethyl)propanamide IUPAC Name: (2R)-N-benzyl-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-benzyl-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CC2)SC(C)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=NN=C(N1C2CC2)S[C@H](C)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C16H20N4OS/c1-11(15(21)17-10-13-6-4-3-5-7-13)22-16-19-18-12(2)20(16)14-8-9-14/h3-7,11,14H,8-10H2,1-2H3,(H,17,21)/t11-/m1/s1