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

Systemtic Name: 2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]-3-(cyclopropylamino)-4-oxidanylidene-2-pyrrolidin-1-yl-butanoic acid Openeye Name: 2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]-3-(cyclopropylamino)-4-oxo-2-pyrrolidin-1-yl-butanoic acid CAS Name: 2-[2-(6-carbamimidoyl-1-ethyl-2-indolyl)ethyl]-3-(cyclopropylamino)-4-oxo-2-(1-pyrrolidinyl)butanoic acid IUPAC Name: 2-[2-(6-carbamimidoyl-1-ethylindol-2-yl)ethyl]-3-(cyclopropylamino)-4-oxo-2-pyrrolidin-1-ylbutanoic acid Traditional Name: 2-[2-(6-amidino-1-ethyl-indol-2-yl)ethyl]-3-(cyclopropylamino)-4-keto-2-pyrrolidino-butyric acid 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(C(C=O)NC3CC3)(C(=O)O)N4CCCC4

Isomeric SMILES

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC(C(C=O)NC3CC3)(C(=O)O)N4CCCC4

InChI

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