S-(1,3-benzothiazol-2-yl) 2-oxidanylidene-7-propoxy-chromene-3-carbothioate

Systemtic Name: S-(1,3-benzothiazol-2-yl) 2-oxidanylidene-7-propoxy-chromene-3-carbothioate Openeye Name: S-(1,3-benzothiazol-2-yl) 2-oxo-7-propoxy-chromene-3-carbothioate CAS Name: 2-oxo-7-propoxy-1-benzopyran-3-carbothioic acid S-(1,3-benzothiazol-2-yl) ester IUPAC Name: S-(1,3-benzothiazol-2-yl) 2-oxo-7-propoxychromene-3-carbothioate Traditional Name: 2-keto-7-propoxy-chromene-3-carbothioic acid S-(1,3-benzothiazol-2-yl) ester Formula: C20H15NO4S2 MolecularWeight: 397.4674

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)SC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCOC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)SC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H15NO4S2/c1-2-9-24-13-8-7-12-10-14(18(22)25-16(12)11-13)19(23)27-20-21-15-5-3-4-6-17(15)26-20/h3-8,10-11H,2,9H2,1H3