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

Systemtic Name: ethyl N-[2-oxidanylidene-4-(pyrimidin-2-ylsulfanylmethyl)chromen-7-yl]carbamate Openeye Name: ethyl N-[2-oxo-4-(pyrimidin-2-ylsulfanylmethyl)chromen-7-yl]carbamate CAS Name: N-[2-oxo-4-[(2-pyrimidinylthio)methyl]-1-benzopyran-7-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-oxo-4-(pyrimidin-2-ylsulfanylmethyl)chromen-7-yl]carbamate Traditional Name: N-[2-keto-4-[(2-pyrimidylthio)methyl]chromen-7-yl]carbamic acid ethyl ester Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O4S/c1-2-23-17(22)20-12-4-5-13-11(8-15(21)24-14(13)9-12)10-25-16-18-6-3-7-19-16/h3-9H,2,10H2,1H3,(H,20,22)