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

Systemtic Name: pyrrolidin-1-yl 2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]-2-(cyclopropylamino)-4-oxidanylidene-butanoate Openeye Name: pyrrolidin-1-yl 2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]-2-(cyclopropylamino)-4-oxo-butanoate CAS Name: 2-[2-(6-carbamimidoyl-1-ethyl-2-indolyl)ethyl]-2-(cyclopropylamino)-4-oxobutanoic acid 1-pyrrolidinyl ester IUPAC Name: pyrrolidin-1-yl 2-[2-(6-carbamimidoyl-1-ethylindol-2-yl)ethyl]-2-(cyclopropylamino)-4-oxobutanoate Traditional Name: 2-[2-(6-amidino-1-ethyl-indol-2-yl)ethyl]-2-(cyclopropylamino)-4-keto-butyric acid pyrrolidino ester Formula: C24H33N5O3 MolecularWeight: 439.55052

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC(CC=O)(C(=O)ON3CCCC3)NC4CC4

Isomeric SMILES

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC(CC=O)(C(=O)ON3CCCC3)NC4CC4

InChI

InChI=1S/C24H33N5O3/c1-2-29-20(15-17-5-6-18(22(25)26)16-21(17)29)9-10-24(11-14-30,27-19-7-8-19)23(31)32-28-12-3-4-13-28/h5-6,14-16,19,27H,2-4,7-13H2,1H3,(H3,25,26)