3-(6-azanyl-3,5-dicyano-4-phenyl-pyridin-2-yl)sulfanyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]propanamide

Systemtic Name: 3-(6-azanyl-3,5-dicyano-4-phenyl-pyridin-2-yl)sulfanyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]propanamide Openeye Name: 3-[(6-amino-3,5-dicyano-4-phenyl-2-pyridyl)sulfanyl]-N-[4-(3-nitrophenyl)thiazol-2-yl]propanamide CAS Name: 3-[(6-amino-3,5-dicyano-4-phenyl-2-pyridinyl)thio]-N-[4-(3-nitrophenyl)-2-thiazolyl]propanamide IUPAC Name: 3-(6-amino-3,5-dicyano-4-phenylpyridin-2-yl)sulfanyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]propanamide Traditional Name: 3-[(6-amino-3,5-dicyano-4-phenyl-2-pyridyl)thio]-N-[4-(3-nitrophenyl)thiazol-2-yl]propionamide Formula: C25H17N7O3S2 MolecularWeight: 527.57758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SCCC(=O)NC3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-])N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SCCC(=O)NC3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-])N)C#N

InChI

InChI=1S/C25H17N7O3S2/c26-12-18-22(15-5-2-1-3-6-15)19(13-27)24(31-23(18)28)36-10-9-21(33)30-25-29-20(14-37-25)16-7-4-8-17(11-16)32(34)35/h1-8,11,14H,9-10H2,(H2,28,31)(H,29,30,33)