methyl 2-[4-[4-[(4-cyanophenyl)carbamoyl]piperazin-1-yl]-7-methoxy-quinazolin-6-yl]oxyethanoate

Systemtic Name: methyl 2-[4-[4-[(4-cyanophenyl)carbamoyl]piperazin-1-yl]-7-methoxy-quinazolin-6-yl]oxyethanoate Openeye Name: methyl 2-[4-[4-[(4-cyanophenyl)carbamoyl]piperazin-1-yl]-7-methoxy-quinazolin-6-yl]oxyacetate CAS Name: 2-[[4-[4-[(4-cyanoanilino)-oxomethyl]-1-piperazinyl]-7-methoxy-6-quinazolinyl]oxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[4-[(4-cyanophenyl)carbamoyl]piperazin-1-yl]-7-methoxyquinazolin-6-yl]oxyacetate Traditional Name: 2-[4-[4-[(4-cyanophenyl)carbamoyl]piperazino]-7-methoxy-quinazolin-6-yl]oxyacetic acid methyl ester Formula: C24H24N6O5 MolecularWeight: 476.48456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C#N)OCC(=O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C#N)OCC(=O)OC

InChI

InChI=1S/C24H24N6O5/c1-33-20-12-19-18(11-21(20)35-14-22(31)34-2)23(27-15-26-19)29-7-9-30(10-8-29)24(32)28-17-5-3-16(13-25)4-6-17/h3-6,11-12,15H,7-10,14H2,1-2H3,(H,28,32)