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

Systemtic Name: 8-methyl-4-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-8-methyl-4-[(1-methyltetrazol-5-yl)sulfanylmethyl]chromen-2-one CAS Name: 7-hydroxy-8-methyl-4-[[(1-methyl-5-tetrazolyl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-8-methyl-4-[(1-methyltetrazol-5-yl)sulfanylmethyl]chromen-2-one Traditional Name: 7-hydroxy-8-methyl-4-[[(1-methyltetrazol-5-yl)thio]methyl]coumarin Formula: C13H12N4O3S MolecularWeight: 304.32438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CSC3=NN=NN3C)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CSC3=NN=NN3C)O

InChI

InChI=1S/C13H12N4O3S/c1-7-10(18)4-3-9-8(5-11(19)20-12(7)9)6-21-13-14-15-16-17(13)2/h3-5,18H,6H2,1-2H3