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

Systemtic Name: (5Z)-6,6-dimethyl-5-(oxidanylmethylidene)-3-propylsulfanyl-1-pyrrolidin-1-ylcarbonyl-7H-2-benzothiophen-4-one Openeye Name: (5Z)-5-(hydroxymethylene)-6,6-dimethyl-3-propylsulfanyl-1-(pyrrolidine-1-carbonyl)-7H-2-benzothiophen-4-one CAS Name: (5Z)-5-(hydroxymethylidene)-6,6-dimethyl-1-[oxo(1-pyrrolidinyl)methyl]-3-(propylthio)-7H-2-benzothiophen-4-one IUPAC Name: (5Z)-5-(hydroxymethylidene)-6,6-dimethyl-3-propylsulfanyl-1-(pyrrolidine-1-carbonyl)-7H-2-benzothiophen-4-one Traditional Name: (5Z)-5-(hydroxymethylene)-6,6-dimethyl-3-(propylthio)-1-(pyrrolidine-1-carbonyl)-7H-isobenzothiophen-4-one Formula: C19H25NO3S2 MolecularWeight: 379.5367

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C2C(=C(S1)C(=O)N3CCCC3)CC(C(=CO)C2=O)(C)C

Isomeric SMILES

CCCSC1=C2C(=C(S1)C(=O)N3CCCC3)CC(/C(=C/O)/C2=O)(C)C

InChI

InChI=1S/C19H25NO3S2/c1-4-9-24-18-14-12(10-19(2,3)13(11-21)15(14)22)16(25-18)17(23)20-7-5-6-8-20/h11,21H,4-10H2,1-3H3/b13-11+