7-methyl-4-[[5-(2-methylprop-2-enylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-6-propan-2-yl-chromen-2-one

Systemtic Name: 7-methyl-4-[[5-(2-methylprop-2-enylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-6-propan-2-yl-chromen-2-one Openeye Name: 6-isopropyl-7-methyl-4-[[5-(2-methylallylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one CAS Name: 7-methyl-4-[[[5-(2-methylprop-2-enylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]-6-propan-2-yl-1-benzopyran-2-one IUPAC Name: 7-methyl-4-[[5-(2-methylprop-2-enylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-6-propan-2-ylchromen-2-one Traditional Name: 6-isopropyl-7-methyl-4-[[[5-(2-methylallylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]coumarin Formula: C20H22N2O2S3 MolecularWeight: 418.59588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(S3)SCC(=C)C)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(S3)SCC(=C)C)C(C)C

InChI

InChI=1S/C20H22N2O2S3/c1-11(2)9-25-19-21-22-20(27-19)26-10-14-7-18(23)24-17-6-13(5)15(12(3)4)8-16(14)17/h6-8,12H,1,9-10H2,2-5H3