2-[(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)sulfanyl]-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 2-[(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)sulfanyl]-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-2-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)sulfanyl]quinazolin-4-one CAS Name: 2-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)thio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)sulfanyl]-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-[(6-chloro-2-keto-4-phenyl-1H-quinolin-3-yl)thio]quinazolin-4-one Formula: C26H18ClN3O2S MolecularWeight: 471.95802

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SC3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SC3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5

InChI

InChI=1S/C26H18ClN3O2S/c1-2-14-30-25(32)18-10-6-7-11-20(18)29-26(30)33-23-22(16-8-4-3-5-9-16)19-15-17(27)12-13-21(19)28-24(23)31/h2-13,15H,1,14H2,(H,28,31)