N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfanyl-butanamide

Systemtic Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfanyl-butanamide Openeye Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfanyl-butanamide CAS Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)thio]butanamide IUPAC Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfanylbutanamide Traditional Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)thio]butyramide Formula: C19H19FN2OS2 MolecularWeight: 374.495363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)SC(=N2)NC(=O)CCCSC3=CC=C(C=C3)F

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)NC(=O)CCCSC3=CC=C(C=C3)F

InChI

InChI=1S/C19H19FN2OS2/c1-12-5-6-13(2)18-17(12)22-19(25-18)21-16(23)4-3-11-24-15-9-7-14(20)8-10-15/h5-10H,3-4,11H2,1-2H3,(H,21,22,23)