(Z)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(5-nitro-2-pyrimidin-2-ylsulfanyl-phenyl)prop-2-enamide

Systemtic Name: (Z)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(5-nitro-2-pyrimidin-2-ylsulfanyl-phenyl)prop-2-enamide Openeye Name: (Z)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(5-nitro-2-pyrimidin-2-ylsulfanyl-phenyl)prop-2-enamide CAS Name: (Z)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[5-nitro-2-(2-pyrimidinylthio)phenyl]-2-propenamide IUPAC Name: (Z)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(5-nitro-2-pyrimidin-2-ylsulfanylphenyl)prop-2-enamide Traditional Name: (Z)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-[5-nitro-2-(2-pyrimidylthio)phenyl]acrylamide Formula: C23H16N6O3S2 MolecularWeight: 488.54154

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C(=CC3=C(C=CC(=C3)[N+](=O)[O-])SC4=NC=CC=N4)C#N)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)/C(=C\C3=C(C=CC(=C3)[N+](=O)[O-])SC4=NC=CC=N4)/C#N)C#N

InChI

InChI=1S/C23H16N6O3S2/c24-12-15(21(30)28-22-18(13-25)17-4-1-2-5-20(17)33-22)10-14-11-16(29(31)32)6-7-19(14)34-23-26-8-3-9-27-23/h3,6-11H,1-2,4-5H2,(H,28,30)/b15-10-