N-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]-2-pyrrol-1-yl-benzamide

Systemtic Name: N-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]-2-pyrrol-1-yl-benzamide Openeye Name: N-[2-(5-carbamimidoyl-2,3-dihydrobenzofuran-3-yl)ethyl]-2-pyrrol-1-yl-benzamide CAS Name: N-[2-(5-carbamimidoyl-2,3-dihydrobenzofuran-3-yl)ethyl]-2-(1-pyrrolyl)benzamide IUPAC Name: N-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]-2-pyrrol-1-ylbenzamide Traditional Name: N-[2-(5-amidinocoumaran-3-yl)ethyl]-2-pyrrol-1-yl-benzamide Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(O1)C=CC(=C2)C(=N)N)CCNC(=O)C3=CC=CC=C3N4C=CC=C4

Isomeric SMILES

C1C(C2=C(O1)C=CC(=C2)C(=N)N)CCNC(=O)C3=CC=CC=C3N4C=CC=C4

InChI

InChI=1S/C22H22N4O2/c23-21(24)15-7-8-20-18(13-15)16(14-28-20)9-10-25-22(27)17-5-1-2-6-19(17)26-11-3-4-12-26/h1-8,11-13,16H,9-10,14H2,(H3,23,24)(H,25,27)