N-(4-ethylphenyl)-4-methyl-2-[(phenylmethyl)amino]pyrimidine-5-carboxamide

Systemtic Name: N-(4-ethylphenyl)-4-methyl-2-[(phenylmethyl)amino]pyrimidine-5-carboxamide Openeye Name: 2-(benzylamino)-N-(4-ethylphenyl)-4-methyl-pyrimidine-5-carboxamide CAS Name: N-(4-ethylphenyl)-4-methyl-2-[(phenylmethyl)amino]-5-pyrimidinecarboxamide IUPAC Name: 2-(benzylamino)-N-(4-ethylphenyl)-4-methylpyrimidine-5-carboxamide Traditional Name: 2-(benzylamino)-N-(4-ethylphenyl)-4-methyl-pyrimidine-5-carboxamide Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=CN=C(N=C2C)NCC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=CN=C(N=C2C)NCC3=CC=CC=C3

InChI

InChI=1S/C21H22N4O/c1-3-16-9-11-18(12-10-16)25-20(26)19-14-23-21(24-15(19)2)22-13-17-7-5-4-6-8-17/h4-12,14H,3,13H2,1-2H3,(H,25,26)(H,22,23,24)