methyl 2-[[(2-methoxyphenyl)methyl-(thiophen-2-ylmethyl)amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[(2-methoxyphenyl)methyl-(thiophen-2-ylmethyl)amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[(2-methoxyphenyl)methyl-(2-thienylmethyl)amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[(2-methoxyphenyl)methyl-(thiophen-2-ylmethyl)amino]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[(2-methoxyphenyl)methyl-(thiophen-2-ylmethyl)amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-[[o-anisyl(2-thenyl)amino]methyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN(CC2=CC=CS2)CC3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1CN(CC2=CC=CS2)CC3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)OC

InChI

InChI=1S/C24H23N3O4S/c1-30-21-8-4-3-6-17(21)13-27(14-18-7-5-11-32-18)15-22-25-20-12-16(24(29)31-2)9-10-19(20)23(28)26-22/h3-12H,13-15H2,1-2H3,(H,25,26,28)