7-ethyl-4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]chromen-2-one

Systemtic Name: 7-ethyl-4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]chromen-2-one Openeye Name: 7-ethyl-4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]chromen-2-one CAS Name: 7-ethyl-4-[[(6-nitro-1,3-benzothiazol-2-yl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-ethyl-4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]chromen-2-one Traditional Name: 7-ethyl-4-[[(6-nitro-1,3-benzothiazol-2-yl)thio]methyl]coumarin Formula: C19H14N2O4S2 MolecularWeight: 398.45546

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H14N2O4S2/c1-2-11-3-5-14-12(8-18(22)25-16(14)7-11)10-26-19-20-15-6-4-13(21(23)24)9-17(15)27-19/h3-9H,2,10H2,1H3