N-(2-hydroxyethyl)-1-oxidanylidene-N-(phenylmethyl)isothiochromene-3-carboxamide

Systemtic Name: N-(2-hydroxyethyl)-1-oxidanylidene-N-(phenylmethyl)isothiochromene-3-carboxamide Openeye Name: N-benzyl-N-(2-hydroxyethyl)-1-oxo-isothiochromene-3-carboxamide CAS Name: N-(2-hydroxyethyl)-1-oxo-N-(phenylmethyl)-2-benzothiopyran-3-carboxamide IUPAC Name: N-benzyl-N-(2-hydroxyethyl)-1-oxoisothiochromene-3-carboxamide Traditional Name: N-benzyl-N-(2-hydroxyethyl)-1-keto-isothiochromene-3-carboxamide Formula: C19H17NO3S MolecularWeight: 339.40818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCO)C(=O)C2=CC3=CC=CC=C3C(=O)S2

Isomeric SMILES

C1=CC=C(C=C1)CN(CCO)C(=O)C2=CC3=CC=CC=C3C(=O)S2

InChI

InChI=1S/C19H17NO3S/c21-11-10-20(13-14-6-2-1-3-7-14)18(22)17-12-15-8-4-5-9-16(15)19(23)24-17/h1-9,12,21H,10-11,13H2