ethyl N-[2-oxidanylidene-4-(pyridin-2-ylsulfanylmethyl)chromen-7-yl]carbamate

Systemtic Name: ethyl N-[2-oxidanylidene-4-(pyridin-2-ylsulfanylmethyl)chromen-7-yl]carbamate Openeye Name: ethyl N-[2-oxo-4-(2-pyridylsulfanylmethyl)chromen-7-yl]carbamate CAS Name: N-[2-oxo-4-[(2-pyridinylthio)methyl]-1-benzopyran-7-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-oxo-4-(pyridin-2-ylsulfanylmethyl)chromen-7-yl]carbamate Traditional Name: N-[2-keto-4-[(2-pyridylthio)methyl]chromen-7-yl]carbamic acid ethyl ester Formula: C18H16N2O4S MolecularWeight: 356.39564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=CC=CC=N3

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=CC=CC=N3

InChI

InChI=1S/C18H16N2O4S/c1-2-23-18(22)20-13-6-7-14-12(9-17(21)24-15(14)10-13)11-25-16-5-3-4-8-19-16/h3-10H,2,11H2,1H3,(H,20,22)