7-chloranyl-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-1H-quinazolin-4-one Formula: C14H12ClN5OS MolecularWeight: 333.79598

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=NN=C2SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

C1CC1N2C=NN=C2SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C14H12ClN5OS/c15-8-1-4-10-11(5-8)17-12(18-13(10)21)6-22-14-19-16-7-20(14)9-2-3-9/h1,4-5,7,9H,2-3,6H2,(H,17,18,21)