N-butyl-1-oxidanylidene-isothiochromene-3-carboxamide

Systemtic Name: N-butyl-1-oxidanylidene-isothiochromene-3-carboxamide Openeye Name: N-butyl-1-oxo-isothiochromene-3-carboxamide CAS Name: N-butyl-1-oxo-2-benzothiopyran-3-carboxamide IUPAC Name: N-butyl-1-oxoisothiochromene-3-carboxamide Traditional Name: N-butyl-1-keto-isothiochromene-3-carboxamide Formula: C14H15NO2S MolecularWeight: 261.3394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC2=CC=CC=C2C(=O)S1

Isomeric SMILES

CCCCNC(=O)C1=CC2=CC=CC=C2C(=O)S1

InChI

InChI=1S/C14H15NO2S/c1-2-3-8-15-13(16)12-9-10-6-4-5-7-11(10)14(17)18-12/h4-7,9H,2-3,8H2,1H3,(H,15,16)