4-[2-[2,5-dimethyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]-2-oxidanylidene-ethoxy]-3-methoxy-benzenecarbonitrile

Systemtic Name: 4-[2-[2,5-dimethyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]-2-oxidanylidene-ethoxy]-3-methoxy-benzenecarbonitrile Openeye Name: 4-[2-[2,5-dimethyl-1-[2-(2-thienyl)ethyl]pyrrol-3-yl]-2-oxo-ethoxy]-3-methoxy-benzonitrile CAS Name: 4-[2-[2,5-dimethyl-1-(2-thiophen-2-ylethyl)-3-pyrrolyl]-2-oxoethoxy]-3-methoxybenzonitrile IUPAC Name: 4-[2-[2,5-dimethyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]-2-oxoethoxy]-3-methoxybenzonitrile Traditional Name: 4-[2-[2,5-dimethyl-1-[2-(2-thienyl)ethyl]pyrrol-3-yl]-2-keto-ethoxy]-3-methoxy-benzonitrile Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CS2)C)C(=O)COC3=C(C=C(C=C3)C#N)OC

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CS2)C)C(=O)COC3=C(C=C(C=C3)C#N)OC

InChI

InChI=1S/C22H22N2O3S/c1-15-11-19(16(2)24(15)9-8-18-5-4-10-28-18)20(25)14-27-21-7-6-17(13-23)12-22(21)26-3/h4-7,10-12H,8-9,14H2,1-3H3