2-[(4-carbamimidoylphenyl)amino]-2-(3-methoxy-4-phenylmethoxy-phenyl)-N-(2-pyridin-2-ylethyl)ethanamide

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-(3-methoxy-4-phenylmethoxy-phenyl)-N-(2-pyridin-2-ylethyl)ethanamide Openeye Name: 2-(4-benzyloxy-3-methoxy-phenyl)-2-(4-carbamimidoylanilino)-N-[2-(2-pyridyl)ethyl]acetamide CAS Name: 2-(4-carbamimidoylanilino)-2-(3-methoxy-4-phenylmethoxyphenyl)-N-[2-(2-pyridinyl)ethyl]acetamide IUPAC Name: 2-(4-carbamimidoylanilino)-2-(3-methoxy-4-phenylmethoxyphenyl)-N-(2-pyridin-2-ylethyl)acetamide Traditional Name: 2-(4-amidinoanilino)-2-(4-benzoxy-3-methoxy-phenyl)-N-[2-(2-pyridyl)ethyl]acetamide Formula: C30H31N5O3 MolecularWeight: 509.59884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C(=O)NCCC2=CC=CC=N2)NC3=CC=C(C=C3)C(=N)N)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(C(=O)NCCC2=CC=CC=N2)NC3=CC=C(C=C3)C(=N)N)OCC4=CC=CC=C4

InChI

InChI=1S/C30H31N5O3/c1-37-27-19-23(12-15-26(27)38-20-21-7-3-2-4-8-21)28(35-25-13-10-22(11-14-25)29(31)32)30(36)34-18-16-24-9-5-6-17-33-24/h2-15,17,19,28,35H,16,18,20H2,1H3,(H3,31,32)(H,34,36)