[5-(methylamino)-5-oxidanylidene-1-thiophen-2-yl-pentyl] benzoate

Systemtic Name: [5-(methylamino)-5-oxidanylidene-1-thiophen-2-yl-pentyl] benzoate Openeye Name: [5-(methylamino)-5-oxo-1-(2-thienyl)pentyl] benzoate CAS Name: benzoic acid [5-(methylamino)-5-oxo-1-thiophen-2-ylpentyl] ester IUPAC Name: [5-(methylamino)-5-oxo-1-thiophen-2-ylpentyl] benzoate Traditional Name: benzoic acid [5-keto-5-(methylamino)-1-(2-thienyl)pentyl] ester Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CCCC(C1=CC=CS1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CNC(=O)CCCC(C1=CC=CS1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H19NO3S/c1-18-16(19)11-5-9-14(15-10-6-12-22-15)21-17(20)13-7-3-2-4-8-13/h2-4,6-8,10,12,14H,5,9,11H2,1H3,(H,18,19)