N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethanamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-[3-(4-methoxyphenyl)pyrazol-1-yl]acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-[3-(4-methoxyphenyl)-1-pyrazolyl]acetamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-[3-(4-methoxyphenyl)pyrazol-1-yl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-ethoxy-2-[3-(4-methoxyphenyl)pyrazol-1-yl]acetamide Formula: C22H25N5O3 MolecularWeight: 407.4656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(=O)NCC1=CC=C(C=C1)C(=N)N)N2C=CC(=N2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(C(=O)NCC1=CC=C(C=C1)C(=N)N)N2C=CC(=N2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H25N5O3/c1-3-30-22(21(28)25-14-15-4-6-17(7-5-15)20(23)24)27-13-12-19(26-27)16-8-10-18(29-2)11-9-16/h4-13,22H,3,14H2,1-2H3,(H3,23,24)(H,25,28)