N-[4-[[4-methyl-6-[methyl(phenyl)amino]-5-nitro-pyrimidin-2-yl]amino]phenyl]ethanamide

Systemtic Name: N-[4-[[4-methyl-6-[methyl(phenyl)amino]-5-nitro-pyrimidin-2-yl]amino]phenyl]ethanamide Openeye Name: N-[4-[[4-methyl-6-(N-methylanilino)-5-nitro-pyrimidin-2-yl]amino]phenyl]acetamide CAS Name: N-[4-[[4-methyl-6-(N-methylanilino)-5-nitro-2-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: N-[4-[[4-methyl-6-(N-methylanilino)-5-nitropyrimidin-2-yl]amino]phenyl]acetamide Traditional Name: N-[4-[[4-methyl-6-(N-methylanilino)-5-nitro-pyrimidin-2-yl]amino]phenyl]acetamide Formula: C20H20N6O3 MolecularWeight: 392.4112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C)N(C)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C)N(C)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N6O3/c1-13-18(26(28)29)19(25(3)17-7-5-4-6-8-17)24-20(21-13)23-16-11-9-15(10-12-16)22-14(2)27/h4-12H,1-3H3,(H,22,27)(H,21,23,24)