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

Systemtic Name: 2-[(1R)-1-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1H-quinazolin-4-one Openeye Name: 2-[(1R)-1-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1H-quinazolin-4-one CAS Name: 2-[(1R)-1-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[(1R)-1-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1H-quinazolin-4-one Traditional Name: 2-[(1R)-1-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]ethyl]-1H-quinazolin-4-one Formula: C15H17N5OS MolecularWeight: 315.39338

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SC(C)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCC1=NC(=NN1)S[C@H](C)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C15H17N5OS/c1-3-6-12-17-15(20-19-12)22-9(2)13-16-11-8-5-4-7-10(11)14(21)18-13/h4-5,7-9H,3,6H2,1-2H3,(H,16,18,21)(H,17,19,20)/t9-/m1/s1