6-chloranyl-7-ethyl-4-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-ethyl-4-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one Openeye Name: 6-chloro-7-ethyl-4-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one CAS Name: 6-chloro-7-ethyl-4-[[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-ethyl-4-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one Traditional Name: 6-chloro-7-ethyl-4-[[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]coumarin Formula: C16H15ClN2O2S3 MolecularWeight: 398.9505

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(S3)SCC)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(S3)SCC)Cl

InChI

InChI=1S/C16H15ClN2O2S3/c1-3-9-5-13-11(7-12(9)17)10(6-14(20)21-13)8-23-16-19-18-15(24-16)22-4-2/h5-7H,3-4,8H2,1-2H3