4-[3-(2,5-dimethylfuran-3-yl)carbonyl-1-(2-methoxyethanoyl)-4-(4-methoxyphenyl)-5-piperazin-1-ylcarbonyl-pyrrolidin-2-yl]benzenecarbonitrile

Systemtic Name: 4-[3-(2,5-dimethylfuran-3-yl)carbonyl-1-(2-methoxyethanoyl)-4-(4-methoxyphenyl)-5-piperazin-1-ylcarbonyl-pyrrolidin-2-yl]benzenecarbonitrile Openeye Name: 4-[3-(2,5-dimethylfuran-3-carbonyl)-1-(2-methoxyacetyl)-4-(4-methoxyphenyl)-5-(piperazine-1-carbonyl)pyrrolidin-2-yl]benzonitrile CAS Name: 4-[3-[(2,5-dimethyl-3-furanyl)-oxomethyl]-1-(2-methoxy-1-oxoethyl)-4-(4-methoxyphenyl)-5-[oxo(1-piperazinyl)methyl]-2-pyrrolidinyl]benzonitrile IUPAC Name: 4-[3-(2,5-dimethylfuran-3-carbonyl)-1-(2-methoxyacetyl)-4-(4-methoxyphenyl)-5-(piperazine-1-carbonyl)pyrrolidin-2-yl]benzonitrile Traditional Name: 4-[3-(2,5-dimethyl-3-furoyl)-1-(2-methoxyacetyl)-4-(4-methoxyphenyl)-5-(piperazine-1-carbonyl)pyrrolidin-2-yl]benzonitrile Formula: C33H36N4O6 MolecularWeight: 584.66214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)C2C(C(N(C2C3=CC=C(C=C3)C#N)C(=O)COC)C(=O)N4CCNCC4)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)C2C(C(N(C2C3=CC=C(C=C3)C#N)C(=O)COC)C(=O)N4CCNCC4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C33H36N4O6/c1-20-17-26(21(2)43-20)32(39)29-28(23-9-11-25(42-4)12-10-23)31(33(40)36-15-13-35-14-16-36)37(27(38)19-41-3)30(29)24-7-5-22(18-34)6-8-24/h5-12,17,28-31,35H,13-16,19H2,1-4H3