4-[(4-ethyl-5-propan-2-yl-1,2,4-triazol-3-yl)-sulfanyl-methyl]-1H-quinolin-2-one

Systemtic Name: 4-[(4-ethyl-5-propan-2-yl-1,2,4-triazol-3-yl)-sulfanyl-methyl]-1H-quinolin-2-one Openeye Name: 4-[(4-ethyl-5-isopropyl-1,2,4-triazol-3-yl)-sulfanyl-methyl]-1H-quinolin-2-one CAS Name: 4-[(4-ethyl-5-propan-2-yl-1,2,4-triazol-3-yl)-mercaptomethyl]-1H-quinolin-2-one IUPAC Name: 4-[(4-ethyl-5-propan-2-yl-1,2,4-triazol-3-yl)-sulfanylmethyl]-1H-quinolin-2-one Traditional Name: 4-[(4-ethyl-5-isopropyl-1,2,4-triazol-3-yl)-mercapto-methyl]carbostyril Formula: C17H20N4OS MolecularWeight: 328.4319

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1C(C2=CC(=O)NC3=CC=CC=C32)S)C(C)C

Isomeric SMILES

CCN1C(=NN=C1C(C2=CC(=O)NC3=CC=CC=C32)S)C(C)C

InChI

InChI=1S/C17H20N4OS/c1-4-21-16(10(2)3)19-20-17(21)15(23)12-9-14(22)18-13-8-6-5-7-11(12)13/h5-10,15,23H,4H2,1-3H3,(H,18,22)