2-(1,3-benzoxazol-2-ylamino)-4,6-dimethyl-N-(4-methylphenyl)pyrimidine-5-carboxamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylamino)-4,6-dimethyl-N-(4-methylphenyl)pyrimidine-5-carboxamide Openeye Name: 2-(1,3-benzoxazol-2-ylamino)-4,6-dimethyl-N-(p-tolyl)pyrimidine-5-carboxamide CAS Name: 2-(1,3-benzoxazol-2-ylamino)-4,6-dimethyl-N-(4-methylphenyl)-5-pyrimidinecarboxamide IUPAC Name: 2-(1,3-benzoxazol-2-ylamino)-4,6-dimethyl-N-(4-methylphenyl)pyrimidine-5-carboxamide Traditional Name: 2-(1,3-benzoxazol-2-ylamino)-4,6-dimethyl-N-(p-tolyl)pyrimidine-5-carboxamide Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(N=C(N=C2C)NC3=NC4=CC=CC=C4O3)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(N=C(N=C2C)NC3=NC4=CC=CC=C4O3)C

InChI

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