N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethyl-pyrrol-2-yl]-2-[4-(3-methoxyphenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethyl-pyrrol-2-yl]-2-[4-(3-methoxyphenyl)piperazin-1-yl]ethanamide Openeye Name: N-[3-cyano-1-(2-furylmethyl)-4,5-dimethyl-pyrrol-2-yl]-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide CAS Name: N-[3-cyano-1-(2-furanylmethyl)-4,5-dimethyl-2-pyrrolyl]-2-[4-(3-methoxyphenyl)-1-piperazinyl]acetamide IUPAC Name: N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethylpyrrol-2-yl]-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide Traditional Name: N-[3-cyano-1-(2-furfuryl)-4,5-dimethyl-pyrrol-2-yl]-2-[4-(3-methoxyphenyl)piperazino]acetamide Formula: C25H29N5O3 MolecularWeight: 447.52946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2CCN(CC2)C3=CC(=CC=C3)OC)CC4=CC=CO4)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2CCN(CC2)C3=CC(=CC=C3)OC)CC4=CC=CO4)C

InChI

InChI=1S/C25H29N5O3/c1-18-19(2)30(16-22-8-5-13-33-22)25(23(18)15-26)27-24(31)17-28-9-11-29(12-10-28)20-6-4-7-21(14-20)32-3/h4-8,13-14H,9-12,16-17H2,1-3H3,(H,27,31)