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

Systemtic Name: 4-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-methyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-7-hydroxy-8-methyl-chromen-2-one CAS Name: 4-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-7-hydroxy-8-methyl-1-benzopyran-2-one IUPAC Name: 4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-7-hydroxy-8-methylchromen-2-one Traditional Name: 4-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-7-hydroxy-8-methyl-coumarin Formula: C13H11N3O3S2 MolecularWeight: 321.37474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CSC3=NN=C(S3)N)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CSC3=NN=C(S3)N)O

InChI

InChI=1S/C13H11N3O3S2/c1-6-9(17)3-2-8-7(4-10(18)19-11(6)8)5-20-13-16-15-12(14)21-13/h2-4,17H,5H2,1H3,(H2,14,15)