3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-quinazolin-4-one

Systemtic Name: 3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-quinazolin-4-one Openeye Name: 3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-quinazolin-4-one CAS Name: 3-[(1H-benzimidazol-2-ylthio)methyl]-2-methyl-4-quinazolinone IUPAC Name: 3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methylquinazolin-4-one Traditional Name: 3-[(1H-benzimidazol-2-ylthio)methyl]-2-methyl-quinazolin-4-one Formula: C17H14N4OS MolecularWeight: 322.38426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C17H14N4OS/c1-11-18-13-7-3-2-6-12(13)16(22)21(11)10-23-17-19-14-8-4-5-9-15(14)20-17/h2-9H,10H2,1H3,(H,19,20)