1-[4-methoxy-3-[(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]phenyl]ethanone

Systemtic Name: 1-[4-methoxy-3-[(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]phenyl]ethanone Openeye Name: 1-[4-methoxy-3-[[5-(4-pyridyl)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenyl]ethanone CAS Name: 1-[4-methoxy-3-[[(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)thio]methyl]phenyl]ethanone IUPAC Name: 1-[4-methoxy-3-[(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]phenyl]ethanone Traditional Name: 1-[4-methoxy-3-[[[5-(4-pyridyl)-1,3,4-thiadiazol-2-yl]thio]methyl]phenyl]ethanone Formula: C17H15N3O2S2 MolecularWeight: 357.4499

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NN=C(S2)C3=CC=NC=C3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NN=C(S2)C3=CC=NC=C3

InChI

InChI=1S/C17H15N3O2S2/c1-11(21)13-3-4-15(22-2)14(9-13)10-23-17-20-19-16(24-17)12-5-7-18-8-6-12/h3-9H,10H2,1-2H3