(2R)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-enyl-propanamide

Systemtic Name: (2R)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-enyl-propanamide Openeye Name: (2R)-N-allyl-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2R)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-prop-2-enylpropanamide IUPAC Name: (2R)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-enylpropanamide Traditional Name: (2R)-N-allyl-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C17H20N4OS MolecularWeight: 328.4319

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)SC1=NN=C(N1C2=CC=CC=C2)C3CC3

Isomeric SMILES

C[C@H](C(=O)NCC=C)SC1=NN=C(N1C2=CC=CC=C2)C3CC3

InChI

InChI=1S/C17H20N4OS/c1-3-11-18-16(22)12(2)23-17-20-19-15(13-9-10-13)21(17)14-7-5-4-6-8-14/h3-8,12-13H,1,9-11H2,2H3,(H,18,22)/t12-/m1/s1