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

Systemtic Name: 7-ethyl-4-[[5-(2-methylprop-2-enylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7-ethyl-4-[[5-(2-methylallylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one CAS Name: 7-ethyl-4-[[[5-(2-methylprop-2-enylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-ethyl-4-[[5-(2-methylprop-2-enylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7-ethyl-4-[[[5-(2-methylallylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]coumarin Formula: C18H18N2O2S3 MolecularWeight: 390.54272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=C(S3)SCC(=C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=C(S3)SCC(=C)C

InChI

InChI=1S/C18H18N2O2S3/c1-4-12-5-6-14-13(8-16(21)22-15(14)7-12)10-24-18-20-19-17(25-18)23-9-11(2)3/h5-8H,2,4,9-10H2,1,3H3