N,N'-bis[1-methyl-5-(2-piperidin-1-ylethylcarbamoyl)pyrrol-3-yl]tridecanediamide

Systemtic Name: N,N'-bis[1-methyl-5-(2-piperidin-1-ylethylcarbamoyl)pyrrol-3-yl]tridecanediamide Openeye Name: N,N'-bis[1-methyl-5-[2-(1-piperidyl)ethylcarbamoyl]pyrrol-3-yl]tridecanediamide CAS Name: N,N'-bis[1-methyl-5-[oxo-[2-(1-piperidinyl)ethylamino]methyl]-3-pyrrolyl]tridecanediamide IUPAC Name: N,N'-bis[1-methyl-5-(2-piperidin-1-ylethylcarbamoyl)pyrrol-3-yl]tridecanediamide Traditional Name: N,N'-bis[1-methyl-5-(2-piperidinoethylcarbamoyl)pyrrol-3-yl]brassylamide Formula: C39H64N8O4 MolecularWeight: 708.97666

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCCN2CCCCC2)NC(=O)CCCCCCCCCCCC(=O)NC3=CN(C(=C3)C(=O)NCCN4CCCCC4)C

Isomeric SMILES

CN1C=C(C=C1C(=O)NCCN2CCCCC2)NC(=O)CCCCCCCCCCCC(=O)NC3=CN(C(=C3)C(=O)NCCN4CCCCC4)C

InChI

InChI=1S/C39H64N8O4/c1-44-30-32(28-34(44)38(50)40-20-26-46-22-14-10-15-23-46)42-36(48)18-12-8-6-4-3-5-7-9-13-19-37(49)43-33-29-35(45(2)31-33)39(51)41-21-27-47-24-16-11-17-25-47/h28-31H,3-27H2,1-2H3,(H,40,50)(H,41,51)(H,42,48)(H,43,49)