methyl 2-[[methyl(thiophen-3-ylmethyl)amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[methyl(thiophen-3-ylmethyl)amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[methyl(3-thienylmethyl)amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[methyl(3-thiophenylmethyl)amino]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[methyl(thiophen-3-ylmethyl)amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-[[methyl(3-thenyl)amino]methyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=C1)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

Isomeric SMILES

CN(CC1=CSC=C1)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C17H17N3O3S/c1-20(8-11-5-6-24-10-11)9-15-18-14-7-12(17(22)23-2)3-4-13(14)16(21)19-15/h3-7,10H,8-9H2,1-2H3,(H,18,19,21)