N-[(3-aminocarbonylphenyl)methyl]-1-[(3-carbamimidoylphenyl)methyl]indole-2-carboxamide

Systemtic Name: N-[(3-aminocarbonylphenyl)methyl]-1-[(3-carbamimidoylphenyl)methyl]indole-2-carboxamide Openeye Name: 1-[(3-carbamimidoylphenyl)methyl]-N-[(3-carbamoylphenyl)methyl]indole-2-carboxamide CAS Name: 1-[(3-carbamimidoylphenyl)methyl]-N-[(3-carbamoylphenyl)methyl]-2-indolecarboxamide IUPAC Name: 1-[(3-carbamimidoylphenyl)methyl]-N-[(3-carbamoylphenyl)methyl]indole-2-carboxamide Traditional Name: 1-(3-amidinobenzyl)-N-(3-carbamoylbenzyl)indole-2-carboxamide Formula: C25H23N5O2 MolecularWeight: 425.48242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N2CC3=CC=CC(=C3)C(=N)N)C(=O)NCC4=CC=CC(=C4)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2CC3=CC=CC(=C3)C(=N)N)C(=O)NCC4=CC=CC(=C4)C(=O)N

InChI

InChI=1S/C25H23N5O2/c26-23(27)19-8-4-6-17(12-19)15-30-21-10-2-1-7-18(21)13-22(30)25(32)29-14-16-5-3-9-20(11-16)24(28)31/h1-13H,14-15H2,(H3,26,27)(H2,28,31)(H,29,32)