3,3-bis(methylsulfanyl)-1-phenyl-2-(1,2,3-triazol-1-yl)prop-2-en-1-one

Systemtic Name: 3,3-bis(methylsulfanyl)-1-phenyl-2-(1,2,3-triazol-1-yl)prop-2-en-1-one Openeye Name: 3,3-bis(methylsulfanyl)-1-phenyl-2-(triazol-1-yl)prop-2-en-1-one CAS Name: 3,3-bis(methylthio)-1-phenyl-2-(1-triazolyl)-2-propen-1-one IUPAC Name: 3,3-bis(methylsulfanyl)-1-phenyl-2-(triazol-1-yl)prop-2-en-1-one Traditional Name: 3,3-bis(methylthio)-1-phenyl-2-(triazol-1-yl)prop-2-en-1-one Formula: C13H13N3OS2 MolecularWeight: 291.39182

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C(C(=O)C1=CC=CC=C1)N2C=CN=N2)SC

Isomeric SMILES

CSC(=C(C(=O)C1=CC=CC=C1)N2C=CN=N2)SC

InChI

InChI=1S/C13H13N3OS2/c1-18-13(19-2)11(16-9-8-14-15-16)12(17)10-6-4-3-5-7-10/h3-9H,1-2H3