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

Systemtic Name: ethyl 4-[2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]pyrrolidin-1-yl]-3-(cyclopropylamino)-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]pyrrolidin-1-yl]-3-(cyclopropylamino)-4-oxo-butanoate CAS Name: 4-[2-[2-(6-carbamimidoyl-1-ethyl-2-indolyl)ethyl]-1-pyrrolidinyl]-3-(cyclopropylamino)-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[2-[2-(6-carbamimidoyl-1-ethylindol-2-yl)ethyl]pyrrolidin-1-yl]-3-(cyclopropylamino)-4-oxobutanoate Traditional Name: 4-[2-[2-(6-amidino-1-ethyl-indol-2-yl)ethyl]pyrrolidino]-3-(cyclopropylamino)-4-keto-butyric acid ethyl ester Formula: C26H37N5O3 MolecularWeight: 467.60368

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3CCCN3C(=O)C(CC(=O)OCC)NC4CC4

Isomeric SMILES

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3CCCN3C(=O)C(CC(=O)OCC)NC4CC4

InChI

InChI=1S/C26H37N5O3/c1-3-30-21(14-17-7-8-18(25(27)28)15-23(17)30)12-11-20-6-5-13-31(20)26(33)22(29-19-9-10-19)16-24(32)34-4-2/h7-8,14-15,19-20,22,29H,3-6,9-13,16H2,1-2H3,(H3,27,28)