1-[2-(4-carbamimidoylphenyl)ethanoyl]-N-methyl-N-piperidin-4-yl-pyrrolidine-2-carboxamide

Systemtic Name: 1-[2-(4-carbamimidoylphenyl)ethanoyl]-N-methyl-N-piperidin-4-yl-pyrrolidine-2-carboxamide Openeye Name: 1-[2-(4-carbamimidoylphenyl)acetyl]-N-methyl-N-(4-piperidyl)pyrrolidine-2-carboxamide CAS Name: 1-[2-(4-carbamimidoylphenyl)-1-oxoethyl]-N-methyl-N-(4-piperidinyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-[2-(4-carbamimidoylphenyl)acetyl]-N-methyl-N-piperidin-4-ylpyrrolidine-2-carboxamide Traditional Name: 1-[2-(4-amidinophenyl)acetyl]-N-methyl-N-(4-piperidyl)pyrrolidine-2-carboxamide Formula: C20H29N5O2 MolecularWeight: 371.47656

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCNCC1)C(=O)C2CCCN2C(=O)CC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CN(C1CCNCC1)C(=O)C2CCCN2C(=O)CC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H29N5O2/c1-24(16-8-10-23-11-9-16)20(27)17-3-2-12-25(17)18(26)13-14-4-6-15(7-5-14)19(21)22/h4-7,16-17,23H,2-3,8-13H2,1H3,(H3,21,22)