(2-pyrrolidin-1-ylcarbonylpyrrolidin-1-yl) 3-azanyl-2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]-4-oxidanylidene-butanoate

Systemtic Name: (2-pyrrolidin-1-ylcarbonylpyrrolidin-1-yl) 3-azanyl-2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]-4-oxidanylidene-butanoate Openeye Name: [2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl] 3-amino-2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]-4-oxo-butanoate CAS Name: 3-amino-2-[2-(6-carbamimidoyl-1-ethyl-2-indolyl)ethyl]-4-oxobutanoic acid [2-[oxo(1-pyrrolidinyl)methyl]-1-pyrrolidinyl] ester IUPAC Name: [2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl] 3-amino-2-[2-(6-carbamimidoyl-1-ethylindol-2-yl)ethyl]-4-oxobutanoate Traditional Name: 2-[2-(6-amidino-1-ethyl-indol-2-yl)ethyl]-3-amino-4-keto-butyric acid [2-(pyrrolidine-1-carbonyl)pyrrolidino] ester Formula: C26H36N6O4 MolecularWeight: 496.60184

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC(C(C=O)N)C(=O)ON3CCCC3C(=O)N4CCCC4

Isomeric SMILES

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC(C(C=O)N)C(=O)ON3CCCC3C(=O)N4CCCC4

InChI

InChI=1S/C26H36N6O4/c1-2-31-19(14-17-7-8-18(24(28)29)15-23(17)31)9-10-20(21(27)16-33)26(35)36-32-13-5-6-22(32)25(34)30-11-3-4-12-30/h7-8,14-16,20-22H,2-6,9-13,27H2,1H3,(H3,28,29)