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

Systemtic Name: 6-chloranyl-7-ethyl-4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one Openeye Name: 6-chloro-7-ethyl-4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one CAS Name: 6-chloro-7-ethyl-4-[[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-ethyl-4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one Traditional Name: 6-chloro-7-ethyl-4-[[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]coumarin Formula: C15H13ClN2O2S3 MolecularWeight: 384.92392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13ClN2O2S3/c1-3-8-4-12-10(6-11(8)16)9(5-13(19)20-12)7-22-15-18-17-14(21-2)23-15/h4-6H,3,7H2,1-2H3