ethyl 2-(5-chloranyl-4-methanoyl-3-methyl-pyrazol-1-yl)-3,3-bis(methylsulfanyl)prop-2-enoate

Systemtic Name: ethyl 2-(5-chloranyl-4-methanoyl-3-methyl-pyrazol-1-yl)-3,3-bis(methylsulfanyl)prop-2-enoate Openeye Name: ethyl 2-(5-chloro-4-formyl-3-methyl-pyrazol-1-yl)-3,3-bis(methylsulfanyl)prop-2-enoate CAS Name: 2-(5-chloro-4-formyl-3-methyl-1-pyrazolyl)-3,3-bis(methylthio)-2-propenoic acid ethyl ester IUPAC Name: ethyl 2-(5-chloro-4-formyl-3-methylpyrazol-1-yl)-3,3-bis(methylsulfanyl)prop-2-enoate Traditional Name: 2-(5-chloro-4-formyl-3-methyl-pyrazol-1-yl)-3,3-bis(methylthio)acrylic acid ethyl ester Formula: C12H15ClN2O3S2 MolecularWeight: 334.8421

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(SC)SC)N1C(=C(C(=N1)C)C=O)Cl

Isomeric SMILES

CCOC(=O)C(=C(SC)SC)N1C(=C(C(=N1)C)C=O)Cl

InChI

InChI=1S/C12H15ClN2O3S2/c1-5-18-11(17)9(12(19-3)20-4)15-10(13)8(6-16)7(2)14-15/h6H,5H2,1-4H3