2-(1H-benzimidazol-2-ylsulfanylmethyl)-1H-quinazolin-4-one

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-1H-quinazolin-4-one Openeye Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-1H-quinazolin-4-one CAS Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-1H-quinazolin-4-one IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-1H-quinazolin-4-one Traditional Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-1H-quinazolin-4-one Formula: C16H12N4OS MolecularWeight: 308.35768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C16H12N4OS/c21-15-10-5-1-2-6-11(10)17-14(20-15)9-22-16-18-12-7-3-4-8-13(12)19-16/h1-8H,9H2,(H,18,19)(H,17,20,21)