2-azanyl-4-(cyanomethyl)-6-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-(cyanomethyl)-6-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-(cyanomethyl)-6-[[4-(3-nitrophenyl)thiazol-2-yl]amino]pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-(cyanomethyl)-6-[[4-(3-nitrophenyl)-2-thiazolyl]amino]pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-(cyanomethyl)-6-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]pyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-(cyanomethyl)-6-[[4-(3-nitrophenyl)thiazol-2-yl]amino]dinicotinonitrile Formula: C18H10N8O2S MolecularWeight: 402.3894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)NC3=C(C(=C(C(=N3)N)C#N)CC#N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)NC3=C(C(=C(C(=N3)N)C#N)CC#N)C#N

InChI

InChI=1S/C18H10N8O2S/c19-5-4-12-13(7-20)16(22)24-17(14(12)8-21)25-18-23-15(9-29-18)10-2-1-3-11(6-10)26(27)28/h1-3,6,9H,4H2,(H3,22,23,24,25)