N-[4-[1-[2-[(4-carbamimidoylphenyl)carbamoylamino]ethanoylamino]ethyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[1-[2-[(4-carbamimidoylphenyl)carbamoylamino]ethanoylamino]ethyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[4-[1-[[2-[(4-carbamimidoylphenyl)carbamoylamino]acetyl]amino]ethyl]phenyl]cyclopropanecarboxamide CAS Name: N-[4-[1-[[2-[[(4-carbamimidoylanilino)-oxomethyl]amino]-1-oxoethyl]amino]ethyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[1-[[2-[(4-carbamimidoylphenyl)carbamoylamino]acetyl]amino]ethyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[4-[1-[[2-[(4-amidinophenyl)carbamoylamino]acetyl]amino]ethyl]phenyl]cyclopropanecarboxamide Formula: C22H26N6O3 MolecularWeight: 422.48024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NC(=O)C2CC2)NC(=O)CNC(=O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(C1=CC=C(C=C1)NC(=O)C2CC2)NC(=O)CNC(=O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C22H26N6O3/c1-13(14-4-8-17(9-5-14)27-21(30)16-2-3-16)26-19(29)12-25-22(31)28-18-10-6-15(7-11-18)20(23)24/h4-11,13,16H,2-3,12H2,1H3,(H3,23,24)(H,26,29)(H,27,30)(H2,25,28,31)