2-[(3-cyano-5,5-dimethyl-7-oxidanylidene-4,6-dihydro-2-benzothiophen-1-yl)sulfanyl]ethyl N-(3-chlorophenyl)carbamate

Systemtic Name: 2-[(3-cyano-5,5-dimethyl-7-oxidanylidene-4,6-dihydro-2-benzothiophen-1-yl)sulfanyl]ethyl N-(3-chlorophenyl)carbamate Openeye Name: 2-[(3-cyano-5,5-dimethyl-7-oxo-4,6-dihydro-2-benzothiophen-1-yl)sulfanyl]ethyl N-(3-chlorophenyl)carbamate CAS Name: N-(3-chlorophenyl)carbamic acid 2-[(3-cyano-5,5-dimethyl-7-oxo-4,6-dihydro-2-benzothiophen-1-yl)thio]ethyl ester IUPAC Name: 2-[(3-cyano-5,5-dimethyl-7-oxo-4,6-dihydro-2-benzothiophen-1-yl)sulfanyl]ethyl N-(3-chlorophenyl)carbamate Traditional Name: N-(3-chlorophenyl)carbamic acid 2-[(3-cyano-7-keto-5,5-dimethyl-4,6-dihydroisobenzothiophen-1-yl)thio]ethyl ester Formula: C20H19ClN2O3S2 MolecularWeight: 434.95946

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(SC(=C2C(=O)C1)SCCOC(=O)NC3=CC(=CC=C3)Cl)C#N)C

Isomeric SMILES

CC1(CC2=C(SC(=C2C(=O)C1)SCCOC(=O)NC3=CC(=CC=C3)Cl)C#N)C

InChI

InChI=1S/C20H19ClN2O3S2/c1-20(2)9-14-16(11-22)28-18(17(14)15(24)10-20)27-7-6-26-19(25)23-13-5-3-4-12(21)8-13/h3-5,8H,6-7,9-10H2,1-2H3,(H,23,25)