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

Systemtic Name: 2-[(1R)-1-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1H-quinazolin-4-one Openeye Name: 2-[(1R)-1-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1H-quinazolin-4-one CAS Name: 2-[(1R)-1-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[(1R)-1-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1H-quinazolin-4-one Traditional Name: 2-[(1R)-1-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]ethyl]-1H-quinazolin-4-one Formula: C16H17N5OS MolecularWeight: 327.40408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CC2)SC(C)C3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=NN=C(N1C2CC2)S[C@H](C)C3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C16H17N5OS/c1-9(23-16-20-19-10(2)21(16)11-7-8-11)14-17-13-6-4-3-5-12(13)15(22)18-14/h3-6,9,11H,7-8H2,1-2H3,(H,17,18,22)/t9-/m1/s1