methyl 4-[[4-[(3-methylphenyl)amino]quinazolin-6-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[[4-[(3-methylphenyl)amino]quinazolin-6-yl]amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[[4-(3-methylanilino)quinazolin-6-yl]amino]-4-oxo-butanoate CAS Name: 4-[[4-(3-methylanilino)-6-quinazolinyl]amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[[4-(3-methylanilino)quinazolin-6-yl]amino]-4-oxobutanoate Traditional Name: 4-keto-4-[[4-(m-toluidino)quinazolin-6-yl]amino]butyric acid methyl ester Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)NC(=O)CCC(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)NC(=O)CCC(=O)OC

InChI

InChI=1S/C20H20N4O3/c1-13-4-3-5-14(10-13)24-20-16-11-15(6-7-17(16)21-12-22-20)23-18(25)8-9-19(26)27-2/h3-7,10-12H,8-9H2,1-2H3,(H,23,25)(H,21,22,24)