N-[4-[[2-[(3-chlorophenyl)amino]-6-methyl-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanamide

Systemtic Name: N-[4-[[2-[(3-chlorophenyl)amino]-6-methyl-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanamide Openeye Name: N-[4-[[2-(3-chloroanilino)-6-methyl-5-nitro-pyrimidin-4-yl]amino]phenyl]acetamide CAS Name: N-[4-[[2-(3-chloroanilino)-6-methyl-5-nitro-4-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: N-[4-[[2-(3-chloroanilino)-6-methyl-5-nitropyrimidin-4-yl]amino]phenyl]acetamide Traditional Name: N-[4-[[2-(3-chloroanilino)-6-methyl-5-nitro-pyrimidin-4-yl]amino]phenyl]acetamide Formula: C19H17ClN6O3 MolecularWeight: 412.82968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)NC2=CC(=CC=C2)Cl)NC3=CC=C(C=C3)NC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)NC2=CC(=CC=C2)Cl)NC3=CC=C(C=C3)NC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C19H17ClN6O3/c1-11-17(26(28)29)18(23-15-8-6-14(7-9-15)22-12(2)27)25-19(21-11)24-16-5-3-4-13(20)10-16/h3-10H,1-2H3,(H,22,27)(H2,21,23,24,25)