2-[(4-carbamimidoylphenyl)amino]-2-[3-methoxy-4-(quinolin-7-ylmethoxy)phenyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-[3-methoxy-4-(quinolin-7-ylmethoxy)phenyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(4-carbamimidoylanilino)-2-[3-methoxy-4-(7-quinolylmethoxy)phenyl]acetamide CAS Name: 2-(4-carbamimidoylanilino)-2-[3-methoxy-4-(7-quinolinylmethoxy)phenyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(4-carbamimidoylanilino)-2-[3-methoxy-4-(quinolin-7-ylmethoxy)phenyl]acetamide Traditional Name: 2-(4-amidinoanilino)-N-benzyl-2-[3-methoxy-4-(7-quinolylmethoxy)phenyl]acetamide Formula: C33H31N5O3 MolecularWeight: 545.63094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C(=O)NCC2=CC=CC=C2)NC3=CC=C(C=C3)C(=N)N)OCC4=CC5=C(C=CC=N5)C=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(C(=O)NCC2=CC=CC=C2)NC3=CC=C(C=C3)C(=N)N)OCC4=CC5=C(C=CC=N5)C=C4

InChI

InChI=1S/C33H31N5O3/c1-40-30-19-26(13-16-29(30)41-21-23-9-10-24-8-5-17-36-28(24)18-23)31(33(39)37-20-22-6-3-2-4-7-22)38-27-14-11-25(12-15-27)32(34)35/h2-19,31,38H,20-21H2,1H3,(H3,34,35)(H,37,39)