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

Systemtic Name: 7-chloranyl-2-[[2-(furan-2-yl)quinazolin-4-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[2-(2-furyl)quinazolin-4-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[[2-(2-furanyl)-4-quinazolinyl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[2-(furan-2-yl)quinazolin-4-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[[2-(2-furyl)quinazolin-4-yl]thio]methyl]-1H-quinazolin-4-one Formula: C21H13ClN4O2S MolecularWeight: 420.87152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=CO3)SCC4=NC(=O)C5=C(N4)C=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=CO3)SCC4=NC(=O)C5=C(N4)C=C(C=C5)Cl

InChI

InChI=1S/C21H13ClN4O2S/c22-12-7-8-13-16(10-12)23-18(25-20(13)27)11-29-21-14-4-1-2-5-15(14)24-19(26-21)17-6-3-9-28-17/h1-10H,11H2,(H,23,25,27)