(7-methoxycarbonyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: (7-methoxycarbonyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Openeye Name: (7-methoxycarbonyl-4-oxo-1H-quinazolin-2-yl)methyl 2-(allylamino)thiazole-4-carboxylate CAS Name: 2-(prop-2-enylamino)-4-thiazolecarboxylic acid (7-methoxycarbonyl-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (7-methoxycarbonyl-4-oxo-1H-quinazolin-2-yl)methyl 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(allylamino)thiazole-4-carboxylic acid (7-carbomethoxy-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C18H16N4O5S MolecularWeight: 400.40844

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CSC(=N3)NCC=C

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CSC(=N3)NCC=C

InChI

InChI=1S/C18H16N4O5S/c1-3-6-19-18-21-13(9-28-18)17(25)27-8-14-20-12-7-10(16(24)26-2)4-5-11(12)15(23)22-14/h3-5,7,9H,1,6,8H2,2H3,(H,19,21)(H,20,22,23)