2-azanyl-5-nitro-3-pyrimidin-2-yl-4-[(2,4,6-trimethylphenyl)amino]benzenecarbonitrile

Systemtic Name: 2-azanyl-5-nitro-3-pyrimidin-2-yl-4-[(2,4,6-trimethylphenyl)amino]benzenecarbonitrile Openeye Name: 2-amino-5-nitro-3-pyrimidin-2-yl-4-(2,4,6-trimethylanilino)benzonitrile CAS Name: 2-amino-5-nitro-3-(2-pyrimidinyl)-4-(2,4,6-trimethylanilino)benzonitrile IUPAC Name: 2-amino-5-nitro-3-pyrimidin-2-yl-4-(2,4,6-trimethylanilino)benzonitrile Traditional Name: 2-amino-4-mesidino-5-nitro-3-(2-pyrimidyl)benzonitrile Formula: C20H18N6O2 MolecularWeight: 374.39592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC2=C(C=C(C(=C2C3=NC=CC=N3)N)C#N)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC2=C(C=C(C(=C2C3=NC=CC=N3)N)C#N)[N+](=O)[O-])C

InChI

InChI=1S/C20H18N6O2/c1-11-7-12(2)18(13(3)8-11)25-19-15(26(27)28)9-14(10-21)17(22)16(19)20-23-5-4-6-24-20/h4-9,25H,22H2,1-3H3