2-(1,3-benzoxazol-2-ylamino)-N-(4-ethanoylphenyl)-4-methyl-pyrimidine-5-carboxamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylamino)-N-(4-ethanoylphenyl)-4-methyl-pyrimidine-5-carboxamide Openeye Name: N-(4-acetylphenyl)-2-(1,3-benzoxazol-2-ylamino)-4-methyl-pyrimidine-5-carboxamide CAS Name: N-(4-acetylphenyl)-2-(1,3-benzoxazol-2-ylamino)-4-methyl-5-pyrimidinecarboxamide IUPAC Name: N-(4-acetylphenyl)-2-(1,3-benzoxazol-2-ylamino)-4-methylpyrimidine-5-carboxamide Traditional Name: N-(4-acetylphenyl)-2-(1,3-benzoxazol-2-ylamino)-4-methyl-pyrimidine-5-carboxamide Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NC2=CC=C(C=C2)C(=O)C)NC3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NC2=CC=C(C=C2)C(=O)C)NC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C21H17N5O3/c1-12-16(19(28)24-15-9-7-14(8-10-15)13(2)27)11-22-20(23-12)26-21-25-17-5-3-4-6-18(17)29-21/h3-11H,1-2H3,(H,24,28)(H,22,23,25,26)