3-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 3-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: 3-[2-(5-carbamimidoyl-2,3-dihydrobenzofuran-3-yl)ethyl]-1-methyl-pyrrole-2-carboxamide CAS Name: 3-[2-(5-carbamimidoyl-2,3-dihydrobenzofuran-3-yl)ethyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 3-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]-1-methylpyrrole-2-carboxamide Traditional Name: 3-[2-(5-amidinocoumaran-3-yl)ethyl]-1-methyl-pyrrole-2-carboxamide Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1C(=O)N)CCC2COC3=C2C=C(C=C3)C(=N)N

Isomeric SMILES

CN1C=CC(=C1C(=O)N)CCC2COC3=C2C=C(C=C3)C(=N)N

InChI

InChI=1S/C17H20N4O2/c1-21-7-6-10(15(21)17(20)22)2-3-12-9-23-14-5-4-11(16(18)19)8-13(12)14/h4-8,12H,2-3,9H2,1H3,(H3,18,19)(H2,20,22)