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

Systemtic Name: 4-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxidanylidene-ethoxy]-3-ethoxy-benzenecarbonitrile Openeye Name: 4-[2-[2,5-dimethyl-1-(2-thienylmethyl)pyrrol-3-yl]-2-oxo-ethoxy]-3-ethoxy-benzonitrile CAS Name: 4-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)-3-pyrrolyl]-2-oxoethoxy]-3-ethoxybenzonitrile IUPAC Name: 4-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxoethoxy]-3-ethoxybenzonitrile Traditional Name: 4-[2-[2,5-dimethyl-1-(2-thenyl)pyrrol-3-yl]-2-keto-ethoxy]-3-ethoxy-benzonitrile Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OCC(=O)C2=C(N(C(=C2)C)CC3=CC=CS3)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OCC(=O)C2=C(N(C(=C2)C)CC3=CC=CS3)C

InChI

InChI=1S/C22H22N2O3S/c1-4-26-22-11-17(12-23)7-8-21(22)27-14-20(25)19-10-15(2)24(16(19)3)13-18-6-5-9-28-18/h5-11H,4,13-14H2,1-3H3