2-(cyanoamino)-N-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidine-4-carboxamide

Systemtic Name: 2-(cyanoamino)-N-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidine-4-carboxamide Openeye Name: 2-(cyanoamino)-N-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidine-4-carboxamide CAS Name: 2-(cyanoamino)-N-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)-4-pyrimidinecarboxamide IUPAC Name: 2-(cyanoamino)-N-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidine-4-carboxamide Traditional Name: 2-(cyanoamino)-N-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidine-4-carboxamide Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=NC(=NC(=C2)C3=CC=C(C=C3)OC)NC#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=NC(=NC(=C2)C3=CC=C(C=C3)OC)NC#N)C

InChI

InChI=1S/C21H19N5O2/c1-13-4-7-16(10-14(13)2)24-20(27)19-11-18(25-21(26-19)23-12-22)15-5-8-17(28-3)9-6-15/h4-11H,1-3H3,(H,24,27)(H,23,25,26)