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

Systemtic Name: 6-chloranyl-7-methyl-4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one Openeye Name: 6-chloro-7-methyl-4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one CAS Name: 6-chloro-7-methyl-4-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]coumarin Formula: C14H11ClN2O2S2 MolecularWeight: 338.83234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(S3)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(S3)C)Cl

InChI

InChI=1S/C14H11ClN2O2S2/c1-7-3-12-10(5-11(7)15)9(4-13(18)19-12)6-20-14-17-16-8(2)21-14/h3-5H,6H2,1-2H3