6-(chloromethyl)-N-(3-nitropyridin-2-yl)sulfanyl-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: 6-(chloromethyl)-N-(3-nitropyridin-2-yl)sulfanyl-2-oxidanylidene-chromene-3-carboxamide Openeye Name: 6-(chloromethyl)-N-[(3-nitro-2-pyridyl)sulfanyl]-2-oxo-chromene-3-carboxamide CAS Name: 6-(chloromethyl)-N-[(3-nitro-2-pyridinyl)thio]-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: 6-(chloromethyl)-N-(3-nitropyridin-2-yl)sulfanyl-2-oxochromene-3-carboxamide Traditional Name: 6-(chloromethyl)-2-keto-N-[(3-nitro-2-pyridyl)thio]chromene-3-carboxamide Formula: C16H10ClN3O5S MolecularWeight: 391.7857

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SNC(=O)C2=CC3=C(C=CC(=C3)CCl)OC2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)SNC(=O)C2=CC3=C(C=CC(=C3)CCl)OC2=O)[N+](=O)[O-]

InChI

InChI=1S/C16H10ClN3O5S/c17-8-9-3-4-13-10(6-9)7-11(16(22)25-13)14(21)19-26-15-12(20(23)24)2-1-5-18-15/h1-7H,8H2,(H,19,21)