N-[[3-(aminomethyl)cyclohexyl]methyl]-1-ethanoyl-4-[2-methoxyethyl(thiophen-2-ylcarbonyl)amino]pyrrolidine-2-carboxamide

Systemtic Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-ethanoyl-4-[2-methoxyethyl(thiophen-2-ylcarbonyl)amino]pyrrolidine-2-carboxamide Openeye Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[2-methoxyethyl(thiophene-2-carbonyl)amino]pyrrolidine-2-carboxamide CAS Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[2-methoxyethyl-[oxo(thiophen-2-yl)methyl]amino]-2-pyrrolidinecarboxamide IUPAC Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[2-methoxyethyl(thiophene-2-carbonyl)amino]pyrrolidine-2-carboxamide Traditional Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[2-methoxyethyl(2-thenoyl)amino]pyrrolidine-2-carboxamide Formula: C23H36N4O4S MolecularWeight: 464.62134

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1C(=O)NCC2CCCC(C2)CN)N(CCOC)C(=O)C3=CC=CS3

Isomeric SMILES

CC(=O)N1CC(CC1C(=O)NCC2CCCC(C2)CN)N(CCOC)C(=O)C3=CC=CS3

InChI

InChI=1S/C23H36N4O4S/c1-16(28)27-15-19(26(8-9-31-2)23(30)21-7-4-10-32-21)12-20(27)22(29)25-14-18-6-3-5-17(11-18)13-24/h4,7,10,17-20H,3,5-6,8-9,11-15,24H2,1-2H3,(H,25,29)