3-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-benzothiophene 1,1-dioxide

Systemtic Name: 3-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-benzothiophene 1,1-dioxide Openeye Name: 3-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]benzothiophene 1,1-dioxide CAS Name: 3-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1-benzothiophene 1,1-dioxide IUPAC Name: 3-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-benzothiophene 1,1-dioxide Traditional Name: 3-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]benzothiophene 1,1-dioxide Formula: C18H14N4O2S2 MolecularWeight: 382.45936

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SC2=CS(=O)(=O)C3=CC=CC=C32)C4=CC=NC=C4

Isomeric SMILES

C=CCN1C(=NN=C1SC2=CS(=O)(=O)C3=CC=CC=C32)C4=CC=NC=C4

InChI

InChI=1S/C18H14N4O2S2/c1-2-11-22-17(13-7-9-19-10-8-13)20-21-18(22)25-15-12-26(23,24)16-6-4-3-5-14(15)16/h2-10,12H,1,11H2