N-(3-carbamimidoylphenyl)-2-[[4-(1-ethanimidoylpiperidin-4-yl)oxyphenyl]amino]ethanamide

Systemtic Name: N-(3-carbamimidoylphenyl)-2-[[4-(1-ethanimidoylpiperidin-4-yl)oxyphenyl]amino]ethanamide Openeye Name: N-(3-carbamimidoylphenyl)-2-[4-[(1-ethanimidoyl-4-piperidyl)oxy]anilino]acetamide CAS Name: N-(3-carbamimidoylphenyl)-2-[4-[[1-(1-iminoethyl)-4-piperidinyl]oxy]anilino]acetamide IUPAC Name: N-(3-carbamimidoylphenyl)-2-[4-(1-ethanimidoylpiperidin-4-yl)oxyanilino]acetamide Traditional Name: 2-[4-[(1-acetimidoyl-4-piperidyl)oxy]anilino]-N-(3-amidinophenyl)acetamide Formula: C22H28N6O2 MolecularWeight: 408.49672

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)OC2=CC=C(C=C2)NCC(=O)NC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CC(=N)N1CCC(CC1)OC2=CC=C(C=C2)NCC(=O)NC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C22H28N6O2/c1-15(23)28-11-9-20(10-12-28)30-19-7-5-17(6-8-19)26-14-21(29)27-18-4-2-3-16(13-18)22(24)25/h2-8,13,20,23,26H,9-12,14H2,1H3,(H3,24,25)(H,27,29)