N-[3-(butylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethoxy-pyridine-3-carboxamide

Systemtic Name: N-[3-(butylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethoxy-pyridine-3-carboxamide Openeye Name: N-[3-(butylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-ethoxy-pyridine-3-carboxamide CAS Name: N-[3-[butylamino(oxo)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethoxy-3-pyridinecarboxamide IUPAC Name: N-[3-(butylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethoxypyridine-3-carboxamide Traditional Name: N-[3-(butylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-ethoxy-nicotinamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C(N=CC=C3)OCC

Isomeric SMILES

CCCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C(N=CC=C3)OCC

InChI

InChI=1S/C21H27N3O3S/c1-3-5-12-22-19(26)17-14-9-6-7-11-16(14)28-21(17)24-18(25)15-10-8-13-23-20(15)27-4-2/h8,10,13H,3-7,9,11-12H2,1-2H3,(H,22,26)(H,24,25)