7-chloranyl-2-[[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[(1-isobutylbenzimidazol-2-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[[1-(2-methylpropyl)-2-benzimidazolyl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[(1-isobutylbenzimidazol-2-yl)thio]methyl]-1H-quinazolin-4-one Formula: C20H19ClN4OS MolecularWeight: 398.90906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2N=C1SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

CC(C)CN1C2=CC=CC=C2N=C1SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C20H19ClN4OS/c1-12(2)10-25-17-6-4-3-5-15(17)23-20(25)27-11-18-22-16-9-13(21)7-8-14(16)19(26)24-18/h3-9,12H,10-11H2,1-2H3,(H,22,24,26)