7-methoxy-4-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one

Systemtic Name: 7-methoxy-4-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7-methoxy-4-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one CAS Name: 7-methoxy-4-[[[5-[(4-methoxyphenyl)methylthio]-1,3,4-thiadiazol-2-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-methoxy-4-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7-methoxy-4-[[[5-(p-anisylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]coumarin Formula: C21H18N2O4S3 MolecularWeight: 458.57362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NN=C(S2)SCC3=CC(=O)OC4=C3C=CC(=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NN=C(S2)SCC3=CC(=O)OC4=C3C=CC(=C4)OC

InChI

InChI=1S/C21H18N2O4S3/c1-25-15-5-3-13(4-6-15)11-28-20-22-23-21(30-20)29-12-14-9-19(24)27-18-10-16(26-2)7-8-17(14)18/h3-10H,11-12H2,1-2H3