2-[(1R)-1-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(1R)-1-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1H-quinazolin-4-one Openeye Name: 2-[(1R)-1-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1H-quinazolin-4-one CAS Name: 2-[(1R)-1-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[(1R)-1-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1H-quinazolin-4-one Traditional Name: 2-[(1R)-1-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)thio]ethyl]-1H-quinazolin-4-one Formula: C18H21N5OS MolecularWeight: 355.45724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2CC2)SC(C)C3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C[C@H](C1=NC(=O)C2=CC=CC=C2N1)SC3=NN=C(N3C4CC4)C(C)C

InChI

InChI=1S/C18H21N5OS/c1-10(2)16-21-22-18(23(16)12-8-9-12)25-11(3)15-19-14-7-5-4-6-13(14)17(24)20-15/h4-7,10-12H,8-9H2,1-3H3,(H,19,20,24)/t11-/m1/s1