2-(1,3-benzoxazol-2-ylsulfanyl)-1-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-[(3R)-3,5-bis(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-(1,3-benzoxazol-2-ylthio)-1-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-1-[(5R)-3,5-bis(2-thienyl)-2-pyrazolin-1-yl]ethanone Formula: C20H15N3O2S3 MolecularWeight: 425.547

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CS2)C(=O)CSC3=NC4=CC=CC=C4O3)C5=CC=CS5

Isomeric SMILES

C1[C@@H](N(N=C1C2=CC=CS2)C(=O)CSC3=NC4=CC=CC=C4O3)C5=CC=CS5

InChI

InChI=1S/C20H15N3O2S3/c24-19(12-28-20-21-13-5-1-2-6-16(13)25-20)23-15(18-8-4-10-27-18)11-14(22-23)17-7-3-9-26-17/h1-10,15H,11-12H2/t15-/m1/s1