1-oxidanylidene-N-[(2-oxidanylnaphthalen-1-yl)-phenyl-methyl]isothiochromene-3-carboxamide

Systemtic Name: 1-oxidanylidene-N-[(2-oxidanylnaphthalen-1-yl)-phenyl-methyl]isothiochromene-3-carboxamide Openeye Name: N-[(2-hydroxy-1-naphthyl)-phenyl-methyl]-1-oxo-isothiochromene-3-carboxamide CAS Name: N-[(2-hydroxy-1-naphthalenyl)-phenylmethyl]-1-oxo-2-benzothiopyran-3-carboxamide IUPAC Name: N-[(2-hydroxynaphthalen-1-yl)-phenylmethyl]-1-oxoisothiochromene-3-carboxamide Traditional Name: N-[(2-hydroxy-1-naphthyl)-phenyl-methyl]-1-keto-isothiochromene-3-carboxamide Formula: C27H19NO3S MolecularWeight: 437.50966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=C(C=CC3=CC=CC=C32)O)NC(=O)C4=CC5=CC=CC=C5C(=O)S4

Isomeric SMILES

C1=CC=C(C=C1)C(C2=C(C=CC3=CC=CC=C32)O)NC(=O)C4=CC5=CC=CC=C5C(=O)S4

InChI

InChI=1S/C27H19NO3S/c29-22-15-14-17-8-4-6-12-20(17)24(22)25(18-9-2-1-3-10-18)28-26(30)23-16-19-11-5-7-13-21(19)27(31)32-23/h1-16,25,29H,(H,28,30)