(2S)-N-[(4-carbamimidoylcyclohexyl)methyl]-1-[(2R,3R)-3-methoxypyrrolidin-2-yl]carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(4-carbamimidoylcyclohexyl)methyl]-1-[(2R,3R)-3-methoxypyrrolidin-2-yl]carbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(4-carbamimidoylcyclohexyl)methyl]-1-[(2R,3R)-3-methoxypyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide CAS Name: (2S)-N-[(4-carbamimidoylcyclohexyl)methyl]-1-[[(2R,3R)-3-methoxy-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(4-carbamimidoylcyclohexyl)methyl]-1-[(2R,3R)-3-methoxypyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[(4-amidinocyclohexyl)methyl]-1-[(2R,3R)-3-methoxyprolyl]pyrrolidine-2-carboxamide Formula: C19H33N5O3 MolecularWeight: 379.49702

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCNC1C(=O)N2CCCC2C(=O)NCC3CCC(CC3)C(=N)N

Isomeric SMILES

CO[C@@H]1CCN[C@H]1C(=O)N2CCC[C@H]2C(=O)NCC3CCC(CC3)C(=N)N

InChI

InChI=1S/C19H33N5O3/c1-27-15-8-9-22-16(15)19(26)24-10-2-3-14(24)18(25)23-11-12-4-6-13(7-5-12)17(20)21/h12-16,22H,2-11H2,1H3,(H3,20,21)(H,23,25)/t12?,13?,14-,15+,16+/m0/s1