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

Systemtic Name: methyl 4-oxidanylidene-2-[(2-thiophen-3-ylpyrrolidin-1-yl)methyl]-1H-quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-2-[[2-(3-thienyl)pyrrolidin-1-yl]methyl]-1H-quinazoline-7-carboxylate CAS Name: 4-oxo-2-[[2-(3-thiophenyl)-1-pyrrolidinyl]methyl]-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-2-[(2-thiophen-3-ylpyrrolidin-1-yl)methyl]-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-[[2-(3-thienyl)pyrrolidino]methyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CN3CCCC3C4=CSC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CN3CCCC3C4=CSC=C4

InChI

InChI=1S/C19H19N3O3S/c1-25-19(24)12-4-5-14-15(9-12)20-17(21-18(14)23)10-22-7-2-3-16(22)13-6-8-26-11-13/h4-6,8-9,11,16H,2-3,7,10H2,1H3,(H,20,21,23)