2-[4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-1,3-thiazol-2-yl]-2-cyclopentylidene-ethanenitrile

Systemtic Name: 2-[4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-1,3-thiazol-2-yl]-2-cyclopentylidene-ethanenitrile Openeye Name: 2-[4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]thiazol-2-yl]-2-cyclopentylidene-acetonitrile CAS Name: 2-[4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-3-pyrrolyl]-2-thiazolyl]-2-cyclopentylideneacetonitrile IUPAC Name: 2-[4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-1,3-thiazol-2-yl]-2-cyclopentylideneacetonitrile Traditional Name: 2-cyclopentylidene-2-[4-(2,5-dimethyl-1-piperonyl-pyrrol-3-yl)thiazol-2-yl]acetonitrile Formula: C24H23N3O2S MolecularWeight: 417.52332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCO3)C)C4=CSC(=N4)C(=C5CCCC5)C#N

Isomeric SMILES

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCO3)C)C4=CSC(=N4)C(=C5CCCC5)C#N

InChI

InChI=1S/C24H23N3O2S/c1-15-9-19(21-13-30-24(26-21)20(11-25)18-5-3-4-6-18)16(2)27(15)12-17-7-8-22-23(10-17)29-14-28-22/h7-10,13H,3-6,12,14H2,1-2H3