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

Systemtic Name: N-(3-aminocarbonyl-4-chloranyl-phenyl)-3-methyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(3-carbamoyl-4-chloro-phenyl)-3-methyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(3-carbamoyl-4-chlorophenyl)-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(3-carbamoyl-4-chlorophenyl)-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(3-carbamoyl-4-chloro-phenyl)-4-keto-3-methyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C17H13ClN4O3S MolecularWeight: 388.82812

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)Cl)C(=O)N)NC1=S

Isomeric SMILES

CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)Cl)C(=O)N)NC1=S

InChI

InChI=1S/C17H13ClN4O3S/c1-22-16(25)10-4-2-8(6-13(10)21-17(22)26)15(24)20-9-3-5-12(18)11(7-9)14(19)23/h2-7H,1H3,(H2,19,23)(H,20,24)(H,21,26)