(2E)-1-cyclopropyl-2-(dimethylaminomethylidene)-3-(5-methylsulfanyl-2,3-dihydro-1,4-benzoxathiin-8-yl)propane-1,3-dione

Systemtic Name: (2E)-1-cyclopropyl-2-(dimethylaminomethylidene)-3-(5-methylsulfanyl-2,3-dihydro-1,4-benzoxathiin-8-yl)propane-1,3-dione Openeye Name: (2E)-1-cyclopropyl-2-(dimethylaminomethylene)-3-(5-methylsulfanyl-2,3-dihydro-1,4-benzoxathiin-8-yl)propane-1,3-dione CAS Name: (2E)-1-cyclopropyl-2-(dimethylaminomethylidene)-3-[5-(methylthio)-2,3-dihydro-1,4-benzoxathiin-8-yl]propane-1,3-dione IUPAC Name: (2E)-1-cyclopropyl-2-(dimethylaminomethylidene)-3-(5-methylsulfanyl-2,3-dihydro-1,4-benzoxathiin-8-yl)propane-1,3-dione Traditional Name: (2E)-1-cyclopropyl-2-(dimethylaminomethylene)-3-[5-(methylthio)-2,3-dihydro-1,4-benzoxathiin-8-yl]propane-1,3-dione Formula: C18H21NO3S2 MolecularWeight: 363.49424

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=C(C(=O)C1CC1)C(=O)C2=C3C(=C(C=C2)SC)SCCO3

Isomeric SMILES

CN(C)/C=C(\C(=O)C1CC1)/C(=O)C2=C3C(=C(C=C2)SC)SCCO3

InChI

InChI=1S/C18H21NO3S2/c1-19(2)10-13(15(20)11-4-5-11)16(21)12-6-7-14(23-3)18-17(12)22-8-9-24-18/h6-7,10-11H,4-5,8-9H2,1-3H3/b13-10+