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

Systemtic Name: N-(5-aminocarbonyl-2-methoxy-phenyl)-4-oxidanylidene-3-pentyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(5-carbamoyl-2-methoxy-phenyl)-4-oxo-3-pentyl-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(5-carbamoyl-2-methoxyphenyl)-4-oxo-3-pentyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(5-carbamoyl-2-methoxyphenyl)-4-oxo-3-pentyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-amyl-N-(5-carbamoyl-2-methoxy-phenyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)C(=O)N)OC)NC1=S

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)C(=O)N)OC)NC1=S

InChI

InChI=1S/C22H24N4O4S/c1-3-4-5-10-26-21(29)15-8-6-14(12-16(15)25-22(26)31)20(28)24-17-11-13(19(23)27)7-9-18(17)30-2/h6-9,11-12H,3-5,10H2,1-2H3,(H2,23,27)(H,24,28)(H,25,31)