2-(5-bromanyl-6-propoxy-1,3-benzothiazol-2-yl)butanebis(thioic S-acid)

Systemtic Name: 2-(5-bromanyl-6-propoxy-1,3-benzothiazol-2-yl)butanebis(thioic S-acid) Openeye Name: 2-(5-bromo-6-propoxy-1,3-benzothiazol-2-yl)butanebis(thioic S-acid) CAS Name: 2-(5-bromo-6-propoxy-1,3-benzothiazol-2-yl)butanebis(thioic S-acid) IUPAC Name: 2-(5-bromo-6-propoxy-1,3-benzothiazol-2-yl)butanebis(thioic S-acid) Traditional Name: 2-(5-bromo-6-propoxy-1,3-benzothiazol-2-yl)butanebis(thioic S-acid) Formula: C14H14BrNO3S3 MolecularWeight: 420.36486

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C2C(=C1)SC(=N2)C(CC(=O)S)C(=O)S)Br

Isomeric SMILES

CCCOC1=C(C=C2C(=C1)SC(=N2)C(CC(=O)S)C(=O)S)Br

InChI

InChI=1S/C14H14BrNO3S3/c1-2-3-19-10-6-11-9(5-8(10)15)16-13(22-11)7(14(18)21)4-12(17)20/h5-7H,2-4H2,1H3,(H,17,20)(H,18,21)