2-[(3-carbamimidoylphenyl)amino]-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]ethanamide

Systemtic Name: 2-[(3-carbamimidoylphenyl)amino]-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]ethanamide Openeye Name: 2-(3-carbamimidoylanilino)-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]acetamide CAS Name: 2-(3-carbamimidoylanilino)-N-[2-[4-(2-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]acetamide IUPAC Name: 2-(3-carbamimidoylanilino)-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]acetamide Traditional Name: 2-(3-amidinoanilino)-N-[2-keto-2-[4-(2-methoxyphenyl)piperazino]ethyl]acetamide Formula: C22H28N6O3 MolecularWeight: 424.49612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)CNC(=O)CNC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)CNC(=O)CNC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C22H28N6O3/c1-31-19-8-3-2-7-18(19)27-9-11-28(12-10-27)21(30)15-26-20(29)14-25-17-6-4-5-16(13-17)22(23)24/h2-8,13,25H,9-12,14-15H2,1H3,(H3,23,24)(H,26,29)