S3,S5-dipyridin-2-yl 1-(phenylmethyl)pyrazole-3,5-dicarbothioate

Systemtic Name: S3,S5-dipyridin-2-yl 1-(phenylmethyl)pyrazole-3,5-dicarbothioate Openeye Name: S3,S5-bis(2-pyridyl) 1-benzylpyrazole-3,5-dicarbothioate CAS Name: 1-(phenylmethyl)pyrazole-3,5-dicarbothioic acid S3,S5-bis(2-pyridinyl) ester IUPAC Name: 3-S,5-S-dipyridin-2-yl 1-benzylpyrazole-3,5-dicarbothioate Traditional Name: 1-benzylpyrazole-3,5-dicarbothioic acid S3,S5-bis(2-pyridyl) ester Formula: C22H16N4O2S2 MolecularWeight: 432.51804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CC(=N2)C(=O)SC3=CC=CC=N3)C(=O)SC4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=CC(=N2)C(=O)SC3=CC=CC=N3)C(=O)SC4=CC=CC=N4

InChI

InChI=1S/C22H16N4O2S2/c27-21(29-19-10-4-6-12-23-19)17-14-18(22(28)30-20-11-5-7-13-24-20)26(25-17)15-16-8-2-1-3-9-16/h1-14H,15H2