2-[(3-chlorophenyl)amino]-N-(cyclohexylmethyl)-4-ethyl-pyrimidine-5-carboxamide

Systemtic Name: 2-[(3-chlorophenyl)amino]-N-(cyclohexylmethyl)-4-ethyl-pyrimidine-5-carboxamide Openeye Name: 2-(3-chloroanilino)-N-(cyclohexylmethyl)-4-ethyl-pyrimidine-5-carboxamide CAS Name: 2-(3-chloroanilino)-N-(cyclohexylmethyl)-4-ethyl-5-pyrimidinecarboxamide IUPAC Name: 2-(3-chloroanilino)-N-(cyclohexylmethyl)-4-ethylpyrimidine-5-carboxamide Traditional Name: 2-(3-chloroanilino)-N-(cyclohexylmethyl)-4-ethyl-pyrimidine-5-carboxamide Formula: C20H25ClN4O MolecularWeight: 372.8917

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NC=C1C(=O)NCC2CCCCC2)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CCC1=NC(=NC=C1C(=O)NCC2CCCCC2)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H25ClN4O/c1-2-18-17(19(26)22-12-14-7-4-3-5-8-14)13-23-20(25-18)24-16-10-6-9-15(21)11-16/h6,9-11,13-14H,2-5,7-8,12H2,1H3,(H,22,26)(H,23,24,25)