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2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-5,6-dimethoxy-2,3-dihydroinden-1-one

2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-5,6-dimethoxy-2,3-dihydroinden-1-one

Systemtic Name:2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-5,6-dimethoxy-2,3-dihydroinden-1-one
Openeye Name:2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-5,6-dimethoxy-indan-1-one
CAS Name:2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-5,6-dimethoxy-2,3-dihydroinden-1-one
IUPAC Name:2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-5,6-dimethoxy-2,3-dihydroinden-1-one
Traditional Name:2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-5,6-dimethoxy-indan-1-one
Formula: C13H14N4O3S
MolecularWeight: 306.34026
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(C2=O)SC3=NNC(=N3)N)OC


Isomeric SMILES

COC1=C(C=C2C(=C1)CC(C2=O)SC3=NNC(=N3)N)OC


InChI

InChI=1S/C13H14N4O3S/c1-19-8-3-6-4-10(21-13-15-12(14)16-17-13)11(18)7(6)5-9(8)20-2/h3,5,10H,4H2,1-2H3,(H3,14,15,16,17)


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