4-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxidanylidene-ethoxy]-2,3-dihydroinden-1-one

Systemtic Name: 4-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxidanylidene-ethoxy]-2,3-dihydroinden-1-one Openeye Name: 4-[2-[2,5-dimethyl-1-(2-thienylmethyl)pyrrol-3-yl]-2-oxo-ethoxy]indan-1-one CAS Name: 4-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)-3-pyrrolyl]-2-oxoethoxy]-2,3-dihydroinden-1-one IUPAC Name: 4-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxoethoxy]-2,3-dihydroinden-1-one Traditional Name: 4-[2-[2,5-dimethyl-1-(2-thenyl)pyrrol-3-yl]-2-keto-ethoxy]indan-1-one Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CS2)C)C(=O)COC3=CC=CC4=C3CCC4=O

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CS2)C)C(=O)COC3=CC=CC4=C3CCC4=O

InChI

InChI=1S/C22H21NO3S/c1-14-11-19(15(2)23(14)12-16-5-4-10-27-16)21(25)13-26-22-7-3-6-17-18(22)8-9-20(17)24/h3-7,10-11H,8-9,12-13H2,1-2H3