2-[(3-nitrophenyl)amino]-4-thiophen-2-yl-pyrimidine-5-carbonitrile

Systemtic Name: 2-[(3-nitrophenyl)amino]-4-thiophen-2-yl-pyrimidine-5-carbonitrile Openeye Name: 2-(3-nitroanilino)-4-(2-thienyl)pyrimidine-5-carbonitrile CAS Name: 2-(3-nitroanilino)-4-thiophen-2-yl-5-pyrimidinecarbonitrile IUPAC Name: 2-(3-nitroanilino)-4-thiophen-2-ylpyrimidine-5-carbonitrile Traditional Name: 2-(3-nitroanilino)-4-(2-thienyl)pyrimidine-5-carbonitrile Formula: C15H9N5O2S MolecularWeight: 323.32926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC2=NC=C(C(=N2)C3=CC=CS3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC2=NC=C(C(=N2)C3=CC=CS3)C#N

InChI

InChI=1S/C15H9N5O2S/c16-8-10-9-17-15(19-14(10)13-5-2-6-23-13)18-11-3-1-4-12(7-11)20(21)22/h1-7,9H,(H,17,18,19)