2-[(2-hexylsulfanyl-1,3-benzothiazol-6-yl)sulfonylamino]butanamide

Systemtic Name: 2-[(2-hexylsulfanyl-1,3-benzothiazol-6-yl)sulfonylamino]butanamide Openeye Name: 2-[(2-hexylsulfanyl-1,3-benzothiazol-6-yl)sulfonylamino]butanamide CAS Name: 2-[[2-(hexylthio)-1,3-benzothiazol-6-yl]sulfonylamino]butanamide IUPAC Name: 2-[(2-hexylsulfanyl-1,3-benzothiazol-6-yl)sulfonylamino]butanamide Traditional Name: 2-[[2-(hexylthio)-1,3-benzothiazol-6-yl]sulfonylamino]butyramide Formula: C17H25N3O3S3 MolecularWeight: 415.5937

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC(CC)C(=O)N

Isomeric SMILES

CCCCCCSC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC(CC)C(=O)N

InChI

InChI=1S/C17H25N3O3S3/c1-3-5-6-7-10-24-17-19-14-9-8-12(11-15(14)25-17)26(22,23)20-13(4-2)16(18)21/h8-9,11,13,20H,3-7,10H2,1-2H3,(H2,18,21)