4-(5-bromanyl-2,4-dimethyl-1H-pyrrol-3-yl)-N-(3-nitrophenyl)pyrimidin-2-amine

Systemtic Name: 4-(5-bromanyl-2,4-dimethyl-1H-pyrrol-3-yl)-N-(3-nitrophenyl)pyrimidin-2-amine Openeye Name: 4-(5-bromo-2,4-dimethyl-1H-pyrrol-3-yl)-N-(3-nitrophenyl)pyrimidin-2-amine CAS Name: 4-(5-bromo-2,4-dimethyl-1H-pyrrol-3-yl)-N-(3-nitrophenyl)-2-pyrimidinamine IUPAC Name: 4-(5-bromo-2,4-dimethyl-1H-pyrrol-3-yl)-N-(3-nitrophenyl)pyrimidin-2-amine Traditional Name: [4-(5-bromo-2,4-dimethyl-1H-pyrrol-3-yl)pyrimidin-2-yl]-(3-nitrophenyl)amine Formula: C16H14BrN5O2 MolecularWeight: 388.21866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrN5O2/c1-9-14(10(2)19-15(9)17)13-6-7-18-16(21-13)20-11-4-3-5-12(8-11)22(23)24/h3-8,19H,1-2H3,(H,18,20,21)