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

Systemtic Name: 1-[(3-carbamimidoylphenyl)methyl]-4-methyl-N-[(3-phenylphenyl)methyl]indole-2-carboxamide Openeye Name: 1-[(3-carbamimidoylphenyl)methyl]-4-methyl-N-[(3-phenylphenyl)methyl]indole-2-carboxamide CAS Name: 1-[(3-carbamimidoylphenyl)methyl]-4-methyl-N-[(3-phenylphenyl)methyl]-2-indolecarboxamide IUPAC Name: 1-[(3-carbamimidoylphenyl)methyl]-4-methyl-N-[(3-phenylphenyl)methyl]indole-2-carboxamide Traditional Name: 1-(3-amidinobenzyl)-4-methyl-N-(3-phenylbenzyl)indole-2-carboxamide Formula: C31H28N4O MolecularWeight: 472.58022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(N(C2=CC=C1)CC3=CC=CC(=C3)C(=N)N)C(=O)NCC4=CC=CC(=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C2C=C(N(C2=CC=C1)CC3=CC=CC(=C3)C(=N)N)C(=O)NCC4=CC=CC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H28N4O/c1-21-8-5-15-28-27(21)18-29(35(28)20-23-10-7-14-26(17-23)30(32)33)31(36)34-19-22-9-6-13-25(16-22)24-11-3-2-4-12-24/h2-18H,19-20H2,1H3,(H3,32,33)(H,34,36)