methyl 2-[[4-[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[4-[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[4-[2-(2-chloroanilino)-2-oxo-ethyl]piperazin-1-yl]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[4-[2-(2-chloroanilino)-2-oxoethyl]-1-piperazinyl]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[4-[2-(2-chloroanilino)-2-oxoethyl]piperazin-1-yl]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[4-[2-(2-chloroanilino)-2-keto-ethyl]piperazino]methyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C23H24ClN5O4 MolecularWeight: 469.92076

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CN3CCN(CC3)CC(=O)NC4=CC=CC=C4Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CN3CCN(CC3)CC(=O)NC4=CC=CC=C4Cl

InChI

InChI=1S/C23H24ClN5O4/c1-33-23(32)15-6-7-16-19(12-15)25-20(27-22(16)31)13-28-8-10-29(11-9-28)14-21(30)26-18-5-3-2-4-17(18)24/h2-7,12H,8-11,13-14H2,1H3,(H,26,30)(H,25,27,31)