1-[(3-carbamimidoylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-4-oxidanyl-indole-2-carboxamide

Systemtic Name: 1-[(3-carbamimidoylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-4-oxidanyl-indole-2-carboxamide Openeye Name: 1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-N-[(3-methoxyphenyl)methyl]indole-2-carboxamide CAS Name: 1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-N-[(3-methoxyphenyl)methyl]-2-indolecarboxamide IUPAC Name: 1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-N-[(3-methoxyphenyl)methyl]indole-2-carboxamide Traditional Name: 1-(3-amidinobenzyl)-4-hydroxy-N-m-anisyl-indole-2-carboxamide Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C2=CC3=C(N2CC4=CC=CC(=C4)C(=N)N)C=CC=C3O

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C2=CC3=C(N2CC4=CC=CC(=C4)C(=N)N)C=CC=C3O

InChI

InChI=1S/C25H24N4O3/c1-32-19-8-3-5-16(12-19)14-28-25(31)22-13-20-21(9-4-10-23(20)30)29(22)15-17-6-2-7-18(11-17)24(26)27/h2-13,30H,14-15H2,1H3,(H3,26,27)(H,28,31)