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7-bromanyl-4-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]chromen-2-one

7-bromanyl-4-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]chromen-2-one

Systemtic Name:7-bromanyl-4-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]chromen-2-one
Openeye Name:7-bromo-4-[[5-(2-thienylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]chromen-2-one
CAS Name:7-bromo-4-[[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-1-benzopyran-2-one
IUPAC Name:7-bromo-4-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]chromen-2-one
Traditional Name:7-bromo-4-[[[5-(2-thenyl)-1H-1,2,4-triazol-3-yl]thio]methyl]coumarin
Formula: C17H12BrN3O2S2
MolecularWeight: 434.33008
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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CC2=NC(=NN2)SCC3=CC(=O)OC4=C3C=CC(=C4)Br


Isomeric SMILES

C1=CSC(=C1)CC2=NC(=NN2)SCC3=CC(=O)OC4=C3C=CC(=C4)Br


InChI

InChI=1S/C17H12BrN3O2S2/c18-11-3-4-13-10(6-16(22)23-14(13)7-11)9-25-17-19-15(20-21-17)8-12-2-1-5-24-12/h1-7H,8-9H2,(H,19,20,21)


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