3-(3-carbamimidoylphenyl)-N-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl]propanamide

Systemtic Name: 3-(3-carbamimidoylphenyl)-N-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl]propanamide Openeye Name: 3-(3-carbamimidoylphenyl)-N-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxo-ethyl]propanamide CAS Name: 3-(3-carbamimidoylphenyl)-N-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]propanamide IUPAC Name: 3-(3-carbamimidoylphenyl)-N-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]propanamide Traditional Name: 3-(3-amidinophenyl)-N-[2-[2-(1H-indol-3-yl)ethylamino]-2-keto-ethyl]propionamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)CNC(=O)CCC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)CNC(=O)CCC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C22H25N5O2/c23-22(24)16-5-3-4-15(12-16)8-9-20(28)27-14-21(29)25-11-10-17-13-26-19-7-2-1-6-18(17)19/h1-7,12-13,26H,8-11,14H2,(H3,23,24)(H,25,29)(H,27,28)