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1-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanylmethyl]benzo[f]chromen-3-one

1-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanylmethyl]benzo[f]chromen-3-one

Systemtic Name:1-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanylmethyl]benzo[f]chromen-3-one
Openeye Name:1-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanylmethyl]benzo[f]chromen-3-one
CAS Name:1-[[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]methyl]-3-benzo[f][1]benzopyranone
IUPAC Name:1-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanylmethyl]benzo[f]chromen-3-one
Traditional Name:1-[[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]methyl]benzo[f]chromen-3-one
Formula: C29H19N3O2S
MolecularWeight: 473.54506
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NC(=N2)SCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4)C6=CC=CC=C6


Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NC(=N2)SCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4)C6=CC=CC=C6


InChI

InChI=1S/C29H19N3O2S/c33-25-17-22(26-23-14-8-7-9-19(23)15-16-24(26)34-25)18-35-29-30-27(20-10-3-1-4-11-20)28(31-32-29)21-12-5-2-6-13-21/h1-17H,18H2


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