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

Systemtic Name: methyl 2-[[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[2-furylmethyl(2-thienylmethyl)amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[2-furanylmethyl(thiophen-2-ylmethyl)amino]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[2-furfuryl(2-thenyl)amino]methyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CN(CC3=CC=CO3)CC4=CC=CS4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CN(CC3=CC=CO3)CC4=CC=CS4

InChI

InChI=1S/C21H19N3O4S/c1-27-21(26)14-6-7-17-18(10-14)22-19(23-20(17)25)13-24(11-15-4-2-8-28-15)12-16-5-3-9-29-16/h2-10H,11-13H2,1H3,(H,22,23,25)