N-(2-dimethylaminoethyl)-4-(4-fluorophenyl)sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-(4-fluorophenyl)sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: N-(2-dimethylaminoethyl)-4-(4-fluorophenyl)sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide CAS Name: N-(2-dimethylaminoethyl)-4-[(4-fluorophenyl)thio]-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: N-(2-dimethylaminoethyl)-4-(4-fluorophenyl)sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: N-(2-dimethylaminoethyl)-4-[(4-fluorophenyl)thio]-N-(6-methyl-1,3-benzothiazol-2-yl)butyramide Formula: C22H26FN3OS2 MolecularWeight: 431.589743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N(CCN(C)C)C(=O)CCCSC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N(CCN(C)C)C(=O)CCCSC3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3OS2/c1-16-6-11-19-20(15-16)29-22(24-19)26(13-12-25(2)3)21(27)5-4-14-28-18-9-7-17(23)8-10-18/h6-11,15H,4-5,12-14H2,1-3H3