N-(3,4-dimethylphenyl)-4-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidine-5-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-4-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidine-5-carboxamide Openeye Name: N-(3,4-dimethylphenyl)-4-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidine-5-carboxamide CAS Name: N-(3,4-dimethylphenyl)-4-(4-ethyl-1-piperazinyl)-2-phenyl-5-pyrimidinecarboxamide IUPAC Name: N-(3,4-dimethylphenyl)-4-(4-ethylpiperazin-1-yl)-2-phenylpyrimidine-5-carboxamide Traditional Name: N-(3,4-dimethylphenyl)-4-(4-ethylpiperazino)-2-phenyl-pyrimidine-5-carboxamide Formula: C25H29N5O MolecularWeight: 415.53066

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=NC=C2C(=O)NC3=CC(=C(C=C3)C)C)C4=CC=CC=C4

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=NC=C2C(=O)NC3=CC(=C(C=C3)C)C)C4=CC=CC=C4

InChI

InChI=1S/C25H29N5O/c1-4-29-12-14-30(15-13-29)24-22(17-26-23(28-24)20-8-6-5-7-9-20)25(31)27-21-11-10-18(2)19(3)16-21/h5-11,16-17H,4,12-15H2,1-3H3,(H,27,31)