2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-6,8-dimethyl-indolizine-1,3-dicarbonitrile

Systemtic Name: 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-6,8-dimethyl-indolizine-1,3-dicarbonitrile Openeye Name: 2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-6,8-dimethyl-indolizine-1,3-dicarbonitrile CAS Name: 2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-6,8-dimethylindolizine-1,3-dicarbonitrile IUPAC Name: 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-6,8-dimethylindolizine-1,3-dicarbonitrile Traditional Name: 2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-6,8-dimethyl-indolizine-1,3-dicarbonitrile Formula: C20H14ClN3OS MolecularWeight: 379.86266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CN2C1=C(C(=C2C#N)SCC(=O)C3=CC=C(C=C3)Cl)C#N)C

Isomeric SMILES

CC1=CC(=CN2C1=C(C(=C2C#N)SCC(=O)C3=CC=C(C=C3)Cl)C#N)C

InChI

InChI=1S/C20H14ClN3OS/c1-12-7-13(2)19-16(8-22)20(17(9-23)24(19)10-12)26-11-18(25)14-3-5-15(21)6-4-14/h3-7,10H,11H2,1-2H3