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

Systemtic Name: N,1-bis[(3-carbamimidoylphenyl)methyl]indole-2-carboxamide Openeye Name: N,1-bis[(3-carbamimidoylphenyl)methyl]indole-2-carboxamide CAS Name: N,1-bis[(3-carbamimidoylphenyl)methyl]-2-indolecarboxamide IUPAC Name: N,1-bis[(3-carbamimidoylphenyl)methyl]indole-2-carboxamide Traditional Name: N,1-bis(3-amidinobenzyl)indole-2-carboxamide Formula: C25H24N6O MolecularWeight: 424.49766

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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(=N)N

Isomeric SMILES

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

InChI

InChI=1S/C25H24N6O/c26-23(27)19-8-3-5-16(11-19)14-30-25(32)22-13-18-7-1-2-10-21(18)31(22)15-17-6-4-9-20(12-17)24(28)29/h1-13H,14-15H2,(H3,26,27)(H3,28,29)(H,30,32)