4-[2-[[4-(dimethylamino)-3-nitro-phenyl]amino]pyrimidin-4-yl]-1,3,5-trimethyl-pyrrole-2-carbonitrile

Systemtic Name: 4-[2-[[4-(dimethylamino)-3-nitro-phenyl]amino]pyrimidin-4-yl]-1,3,5-trimethyl-pyrrole-2-carbonitrile Openeye Name: 4-[2-[4-(dimethylamino)-3-nitro-anilino]pyrimidin-4-yl]-1,3,5-trimethyl-pyrrole-2-carbonitrile CAS Name: 4-[2-[4-(dimethylamino)-3-nitroanilino]-4-pyrimidinyl]-1,3,5-trimethyl-2-pyrrolecarbonitrile IUPAC Name: 4-[2-[4-(dimethylamino)-3-nitroanilino]pyrimidin-4-yl]-1,3,5-trimethylpyrrole-2-carbonitrile Traditional Name: 4-[2-[4-(dimethylamino)-3-nitro-anilino]pyrimidin-4-yl]-1,3,5-trimethyl-pyrrole-2-carbonitrile Formula: C20H21N7O2 MolecularWeight: 391.42644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C2=NC(=NC=C2)NC3=CC(=C(C=C3)N(C)C)[N+](=O)[O-])C)C)C#N

Isomeric SMILES

CC1=C(N(C(=C1C2=NC(=NC=C2)NC3=CC(=C(C=C3)N(C)C)[N+](=O)[O-])C)C)C#N

InChI

InChI=1S/C20H21N7O2/c1-12-18(11-21)26(5)13(2)19(12)15-8-9-22-20(24-15)23-14-6-7-16(25(3)4)17(10-14)27(28)29/h6-10H,1-5H3,(H,22,23,24)