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

Systemtic Name: ethyl 3-azanyl-4-[2-[2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]pyrrolidin-1-yl]carbonylpyrrolidin-1-yl]-4-oxidanylidene-butanoate Openeye Name: ethyl 3-amino-4-[2-[2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]pyrrolidine-1-carbonyl]pyrrolidin-1-yl]-4-oxo-butanoate CAS Name: 3-amino-4-[2-[[2-[2-(6-carbamimidoyl-1-ethyl-2-indolyl)ethyl]-1-pyrrolidinyl]-oxomethyl]-1-pyrrolidinyl]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 3-amino-4-[2-[2-[2-(6-carbamimidoyl-1-ethylindol-2-yl)ethyl]pyrrolidine-1-carbonyl]pyrrolidin-1-yl]-4-oxobutanoate Traditional Name: 4-[2-[2-[2-(6-amidino-1-ethyl-indol-2-yl)ethyl]pyrrolidine-1-carbonyl]pyrrolidino]-3-amino-4-keto-butyric acid ethyl ester Formula: C28H40N6O4 MolecularWeight: 524.655

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3CCCN3C(=O)C4CCCN4C(=O)C(CC(=O)OCC)N

Isomeric SMILES

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3CCCN3C(=O)C4CCCN4C(=O)C(CC(=O)OCC)N

InChI

InChI=1S/C28H40N6O4/c1-3-32-21(15-18-9-10-19(26(30)31)16-24(18)32)12-11-20-7-5-13-33(20)28(37)23-8-6-14-34(23)27(36)22(29)17-25(35)38-4-2/h9-10,15-16,20,22-23H,3-8,11-14,17,29H2,1-2H3,(H3,30,31)