ethyl 2-[[4-[3-(dimethylamino)-2-oxidanyl-propoxy]phenyl]amino]-4-phenylazanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[[4-[3-(dimethylamino)-2-oxidanyl-propoxy]phenyl]amino]-4-phenylazanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-anilino-2-[4-[3-(dimethylamino)-2-hydroxy-propoxy]anilino]pyrimidine-5-carboxylate CAS Name: 4-anilino-2-[4-[3-(dimethylamino)-2-hydroxypropoxy]anilino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-anilino-2-[4-[3-(dimethylamino)-2-hydroxypropoxy]anilino]pyrimidine-5-carboxylate Traditional Name: 4-anilino-2-[4-[3-(dimethylamino)-2-hydroxy-propoxy]anilino]pyrimidine-5-carboxylic acid ethyl ester Formula: C24H29N5O4 MolecularWeight: 451.51816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=CC=CC=C2)NC3=CC=C(C=C3)OCC(CN(C)C)O

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=CC=CC=C2)NC3=CC=C(C=C3)OCC(CN(C)C)O

InChI

InChI=1S/C24H29N5O4/c1-4-32-23(31)21-14-25-24(28-22(21)26-17-8-6-5-7-9-17)27-18-10-12-20(13-11-18)33-16-19(30)15-29(2)3/h5-14,19,30H,4,15-16H2,1-3H3,(H2,25,26,27,28)