N-(5-chloranyl-2-methoxy-phenyl)-4-oxidanylidene-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-4-oxidanylidene-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-4-oxo-3-phenyl-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(5-chloro-2-methoxyphenyl)-4-oxo-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-4-oxo-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-4-keto-3-phenyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H16ClN3O3S MolecularWeight: 437.89874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC=CC=C4

InChI

InChI=1S/C22H16ClN3O3S/c1-29-19-10-8-14(23)12-18(19)24-20(27)13-7-9-16-17(11-13)25-22(30)26(21(16)28)15-5-3-2-4-6-15/h2-12H,1H3,(H,24,27)(H,25,30)