4-[[4-[(2-methoxyphenyl)amino]-6-methyl-5-nitro-pyrimidin-2-yl]amino]-3-methyl-phenol

Systemtic Name: 4-[[4-[(2-methoxyphenyl)amino]-6-methyl-5-nitro-pyrimidin-2-yl]amino]-3-methyl-phenol Openeye Name: 4-[[4-(2-methoxyanilino)-6-methyl-5-nitro-pyrimidin-2-yl]amino]-3-methyl-phenol CAS Name: 4-[[4-(2-methoxyanilino)-6-methyl-5-nitro-2-pyrimidinyl]amino]-3-methylphenol IUPAC Name: 4-[[4-(2-methoxyanilino)-6-methyl-5-nitropyrimidin-2-yl]amino]-3-methylphenol Traditional Name: 3-methyl-4-[[4-methyl-5-nitro-6-(o-anisidino)pyrimidin-2-yl]amino]phenol Formula: C19H19N5O4 MolecularWeight: 381.38526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)O)NC2=NC(=C(C(=N2)NC3=CC=CC=C3OC)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=CC(=C1)O)NC2=NC(=C(C(=N2)NC3=CC=CC=C3OC)[N+](=O)[O-])C

InChI

InChI=1S/C19H19N5O4/c1-11-10-13(25)8-9-14(11)22-19-20-12(2)17(24(26)27)18(23-19)21-15-6-4-5-7-16(15)28-3/h4-10,25H,1-3H3,(H2,20,21,22,23)