6-chloranyl-2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanylmethyl]-6-chloro-1H-quinazolin-4-one CAS Name: 6-chloro-2-[[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanylmethyl]-6-chloro-1H-quinazolin-4-one Traditional Name: 2-[[(4-benzyl-5-methyl-1H-imidazol-2-yl)thio]methyl]-6-chloro-1H-quinazolin-4-one Formula: C20H17ClN4OS MolecularWeight: 396.89318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)SCC2=NC(=O)C3=C(N2)C=CC(=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(N1)SCC2=NC(=O)C3=C(N2)C=CC(=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C20H17ClN4OS/c1-12-17(9-13-5-3-2-4-6-13)24-20(22-12)27-11-18-23-16-8-7-14(21)10-15(16)19(26)25-18/h2-8,10H,9,11H2,1H3,(H,22,24)(H,23,25,26)