4-(3-cyclohexyl-5-methyl-1,2-oxazol-4-yl)-N-(3-nitrophenyl)pyrimidin-2-amine

Systemtic Name: 4-(3-cyclohexyl-5-methyl-1,2-oxazol-4-yl)-N-(3-nitrophenyl)pyrimidin-2-amine Openeye Name: 4-(3-cyclohexyl-5-methyl-isoxazol-4-yl)-N-(3-nitrophenyl)pyrimidin-2-amine CAS Name: 4-(3-cyclohexyl-5-methyl-4-isoxazolyl)-N-(3-nitrophenyl)-2-pyrimidinamine IUPAC Name: 4-(3-cyclohexyl-5-methyl-1,2-oxazol-4-yl)-N-(3-nitrophenyl)pyrimidin-2-amine Traditional Name: [4-(3-cyclohexyl-5-methyl-isoxazol-4-yl)pyrimidin-2-yl]-(3-nitrophenyl)amine Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2CCCCC2)C3=NC(=NC=C3)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C2CCCCC2)C3=NC(=NC=C3)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O3/c1-13-18(19(24-28-13)14-6-3-2-4-7-14)17-10-11-21-20(23-17)22-15-8-5-9-16(12-15)25(26)27/h5,8-12,14H,2-4,6-7H2,1H3,(H,21,22,23)