N-(4-chlorophenyl)-2-ethylsulfanyl-3-methyl-3-nitro-6-oxidanylidene-4-thiophen-2-yl-cyclohexene-1-carboxamide

Systemtic Name: N-(4-chlorophenyl)-2-ethylsulfanyl-3-methyl-3-nitro-6-oxidanylidene-4-thiophen-2-yl-cyclohexene-1-carboxamide Openeye Name: N-(4-chlorophenyl)-2-ethylsulfanyl-3-methyl-3-nitro-6-oxo-4-(2-thienyl)cyclohexene-1-carboxamide CAS Name: N-(4-chlorophenyl)-2-(ethylthio)-3-methyl-3-nitro-6-oxo-4-thiophen-2-yl-1-cyclohexenecarboxamide IUPAC Name: N-(4-chlorophenyl)-2-ethylsulfanyl-3-methyl-3-nitro-6-oxo-4-thiophen-2-ylcyclohexene-1-carboxamide Traditional Name: N-(4-chlorophenyl)-2-(ethylthio)-6-keto-3-methyl-3-nitro-4-(2-thienyl)cyclohexene-1-carboxamide Formula: C20H19ClN2O4S2 MolecularWeight: 450.95886

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=O)CC(C1(C)[N+](=O)[O-])C2=CC=CS2)C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CCSC1=C(C(=O)CC(C1(C)[N+](=O)[O-])C2=CC=CS2)C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19ClN2O4S2/c1-3-28-18-17(19(25)22-13-8-6-12(21)7-9-13)15(24)11-14(16-5-4-10-29-16)20(18,2)23(26)27/h4-10,14H,3,11H2,1-2H3,(H,22,25)