4-(benzimidazol-1-yl)-N-[1-(5-nitrothiophen-2-yl)ethyl]pyrimidin-2-amine

Systemtic Name: 4-(benzimidazol-1-yl)-N-[1-(5-nitrothiophen-2-yl)ethyl]pyrimidin-2-amine Openeye Name: 4-(benzimidazol-1-yl)-N-[1-(5-nitro-2-thienyl)ethyl]pyrimidin-2-amine CAS Name: 4-(1-benzimidazolyl)-N-[1-(5-nitro-2-thiophenyl)ethyl]-2-pyrimidinamine IUPAC Name: 4-(benzimidazol-1-yl)-N-[1-(5-nitrothiophen-2-yl)ethyl]pyrimidin-2-amine Traditional Name: [4-(benzimidazol-1-yl)pyrimidin-2-yl]-[1-(5-nitro-2-thienyl)ethyl]amine Formula: C17H14N6O2S MolecularWeight: 366.39706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(S1)[N+](=O)[O-])NC2=NC=CC(=N2)N3C=NC4=CC=CC=C43

Isomeric SMILES

CC(C1=CC=C(S1)[N+](=O)[O-])NC2=NC=CC(=N2)N3C=NC4=CC=CC=C43

InChI

InChI=1S/C17H14N6O2S/c1-11(14-6-7-16(26-14)23(24)25)20-17-18-9-8-15(21-17)22-10-19-12-4-2-3-5-13(12)22/h2-11H,1H3,(H,18,20,21)