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

Systemtic Name: (2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-N-phenyl-propanamide Openeye Name: (2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-N-phenyl-propanamide CAS Name: (2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-N-methyl-N-phenylpropanamide IUPAC Name: (2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-N-phenylpropanamide Traditional Name: (2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-N-methyl-N-phenyl-propionamide Formula: C18H22N4OS MolecularWeight: 342.45848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1=CC=CC=C1)SC2=NN=C(N2C3CC3)C4CC4

Isomeric SMILES

C[C@H](C(=O)N(C)C1=CC=CC=C1)SC2=NN=C(N2C3CC3)C4CC4

InChI

InChI=1S/C18H22N4OS/c1-12(17(23)21(2)14-6-4-3-5-7-14)24-18-20-19-16(13-8-9-13)22(18)15-10-11-15/h3-7,12-13,15H,8-11H2,1-2H3/t12-/m1/s1