2-(1,3-benzodioxol-5-yl)-1-[5-(5-chloranylthiophen-2-yl)-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-1-[5-(5-chloranylthiophen-2-yl)-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 2-(1,3-benzodioxol-5-yl)-1-[5-(5-chloro-2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-(1,3-benzodioxol-5-yl)-1-[5-(5-chloro-2-thiophenyl)-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-(1,3-benzodioxol-5-yl)-1-[5-(5-chlorothiophen-2-yl)-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 2-(1,3-benzodioxol-5-yl)-1-[3-(5-chloro-2-thienyl)-2-pyrazolin-1-yl]ethanone Formula: C16H13ClN2O3S MolecularWeight: 348.80402

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC=C(S2)Cl)C(=O)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(N=C1C2=CC=C(S2)Cl)C(=O)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C16H13ClN2O3S/c17-15-4-3-14(23-15)11-5-6-19(18-11)16(20)8-10-1-2-12-13(7-10)22-9-21-12/h1-4,7H,5-6,8-9H2