(5Z)-3-ethylsulfanyl-6,6-dimethyl-5-(oxidanylmethylidene)-1-pyrrolidin-1-ylcarbonyl-7H-2-benzothiophen-4-one

Systemtic Name: (5Z)-3-ethylsulfanyl-6,6-dimethyl-5-(oxidanylmethylidene)-1-pyrrolidin-1-ylcarbonyl-7H-2-benzothiophen-4-one Openeye Name: (5Z)-3-ethylsulfanyl-5-(hydroxymethylene)-6,6-dimethyl-1-(pyrrolidine-1-carbonyl)-7H-2-benzothiophen-4-one CAS Name: (5Z)-3-(ethylthio)-5-(hydroxymethylidene)-6,6-dimethyl-1-[oxo(1-pyrrolidinyl)methyl]-7H-2-benzothiophen-4-one IUPAC Name: (5Z)-3-ethylsulfanyl-5-(hydroxymethylidene)-6,6-dimethyl-1-(pyrrolidine-1-carbonyl)-7H-2-benzothiophen-4-one Traditional Name: (5Z)-3-(ethylthio)-5-(hydroxymethylene)-6,6-dimethyl-1-(pyrrolidine-1-carbonyl)-7H-isobenzothiophen-4-one Formula: C18H23NO3S2 MolecularWeight: 365.51012

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C2C(=C(S1)C(=O)N3CCCC3)CC(C(=CO)C2=O)(C)C

Isomeric SMILES

CCSC1=C2C(=C(S1)C(=O)N3CCCC3)CC(/C(=C/O)/C2=O)(C)C

InChI

InChI=1S/C18H23NO3S2/c1-4-23-17-13-11(9-18(2,3)12(10-20)14(13)21)15(24-17)16(22)19-7-5-6-8-19/h10,20H,4-9H2,1-3H3/b12-10+