5-carbamimidoyl-4-(2,3-dihydro-1-benzofuran-3-yl)-3-ethyl-5-methyl-indole-2-carboxamide

Systemtic Name: 5-carbamimidoyl-4-(2,3-dihydro-1-benzofuran-3-yl)-3-ethyl-5-methyl-indole-2-carboxamide Openeye Name: 5-carbamimidoyl-4-(2,3-dihydrobenzofuran-3-yl)-3-ethyl-5-methyl-indole-2-carboxamide CAS Name: 5-carbamimidoyl-4-(2,3-dihydrobenzofuran-3-yl)-3-ethyl-5-methyl-2-indolecarboxamide IUPAC Name: 5-carbamimidoyl-4-(2,3-dihydro-1-benzofuran-3-yl)-3-ethyl-5-methylindole-2-carboxamide Traditional Name: 5-amidino-4-coumaran-3-yl-3-ethyl-5-methyl-indole-2-carboxamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C1=C(C(C=C2)(C)C(=N)N)C3COC4=CC=CC=C34)C(=O)N

Isomeric SMILES

CCC1=C(N=C2C1=C(C(C=C2)(C)C(=N)N)C3COC4=CC=CC=C34)C(=O)N

InChI

InChI=1S/C21H22N4O2/c1-3-11-16-14(25-18(11)19(22)26)8-9-21(2,20(23)24)17(16)13-10-27-15-7-5-4-6-12(13)15/h4-9,13H,3,10H2,1-2H3,(H2,22,26)(H3,23,24)