5-[5-imidazol-1-yl-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-4-yl]thiophene-2-carbonitrile

Systemtic Name: 5-[5-imidazol-1-yl-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-4-yl]thiophene-2-carbonitrile Openeye Name: 5-[5-imidazol-1-yl-2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidin-4-yl]thiophene-2-carbonitrile CAS Name: 5-[5-(1-imidazolyl)-2-[2-[(5-nitro-2-pyridinyl)amino]ethylamino]-4-pyrimidinyl]-2-thiophenecarbonitrile IUPAC Name: 5-[5-imidazol-1-yl-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-4-yl]thiophene-2-carbonitrile Traditional Name: 5-[5-imidazol-1-yl-2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidin-4-yl]thiophene-2-carbonitrile Formula: C19H15N9O2S MolecularWeight: 433.4465

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1[N+](=O)[O-])NCCNC2=NC=C(C(=N2)C3=CC=C(S3)C#N)N4C=CN=C4

Isomeric SMILES

C1=CC(=NC=C1[N+](=O)[O-])NCCNC2=NC=C(C(=N2)C3=CC=C(S3)C#N)N4C=CN=C4

InChI

InChI=1S/C19H15N9O2S/c20-9-14-2-3-16(31-14)18-15(27-8-7-21-12-27)11-25-19(26-18)23-6-5-22-17-4-1-13(10-24-17)28(29)30/h1-4,7-8,10-12H,5-6H2,(H,22,24)(H,23,25,26)