4-(3-azanylpropyl)-N-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]benzamide

Systemtic Name: 4-(3-azanylpropyl)-N-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]benzamide Openeye Name: 4-(3-aminopropyl)-N-[2-(5-carbamimidoyl-2,3-dihydrobenzofuran-3-yl)ethyl]benzamide CAS Name: 4-(3-aminopropyl)-N-[2-(5-carbamimidoyl-2,3-dihydrobenzofuran-3-yl)ethyl]benzamide IUPAC Name: 4-(3-aminopropyl)-N-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]benzamide Traditional Name: N-[2-(5-amidinocoumaran-3-yl)ethyl]-4-(3-aminopropyl)benzamide Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O2/c22-10-1-2-14-3-5-15(6-4-14)21(26)25-11-9-17-13-27-19-8-7-16(20(23)24)12-18(17)19/h3-8,12,17H,1-2,9-11,13,22H2,(H3,23,24)(H,25,26)