4-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-8-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-8-methyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[[4-(4-chlorophenyl)-5-thioxo-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-7-hydroxy-8-methyl-chromen-2-one CAS Name: 4-[[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]thio]methyl]-7-hydroxy-8-methyl-1-benzopyran-2-one IUPAC Name: 4-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-7-hydroxy-8-methylchromen-2-one Traditional Name: 4-[[[4-(4-chlorophenyl)-5-thioxo-1,3,4-thiadiazol-2-yl]thio]methyl]-7-hydroxy-8-methyl-coumarin Formula: C19H13ClN2O3S3 MolecularWeight: 448.96612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CSC3=NN(C(=S)S3)C4=CC=C(C=C4)Cl)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CSC3=NN(C(=S)S3)C4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C19H13ClN2O3S3/c1-10-15(23)7-6-14-11(8-16(24)25-17(10)14)9-27-18-21-22(19(26)28-18)13-4-2-12(20)3-5-13/h2-8,23H,9H2,1H3