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

Systemtic Name: N-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[2-(5-carbamimidoyl-2,3-dihydrobenzofuran-3-yl)ethyl]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[2-(5-carbamimidoyl-2,3-dihydrobenzofuran-3-yl)ethyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]-1-methylpyrrole-2-carboxamide Traditional Name: N-[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)NCCC2COC3=C2C=C(C=C3)C(=N)N

Isomeric SMILES

CN1C=CC=C1C(=O)NCCC2COC3=C2C=C(C=C3)C(=N)N

InChI

InChI=1S/C17H20N4O2/c1-21-8-2-3-14(21)17(22)20-7-6-12-10-23-15-5-4-11(16(18)19)9-13(12)15/h2-5,8-9,12H,6-7,10H2,1H3,(H3,18,19)(H,20,22)