10-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-8-oxidanylidene-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile

Systemtic Name: 10-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-8-oxidanylidene-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile Openeye Name: 10-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-8-oxo-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile CAS Name: 10-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-8-oxo-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile IUPAC Name: 10-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-8-oxo-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile Traditional Name: 10-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-8-keto-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile Formula: C20H18ClN3O2S MolecularWeight: 399.89382

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C(C(=O)NC(=C2C#N)SCC(=O)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

C1CCC2(CC1)C(C(=O)NC(=C2C#N)SCC(=O)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C20H18ClN3O2S/c21-14-6-4-13(5-7-14)17(25)12-27-19-16(11-23)20(8-2-1-3-9-20)15(10-22)18(26)24-19/h4-7,15H,1-3,8-9,12H2,(H,24,26)