4-(4-fluorophenyl)sulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)butanamide

Systemtic Name: 4-(4-fluorophenyl)sulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-4-(4-fluorophenyl)sulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-(4-fluorophenyl)sulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-4-(4-fluorophenyl)sulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: N-benzyl-4-(4-fluorophenyl)sulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)butyramide Formula: C25H23FN2O3S2 MolecularWeight: 482.590123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)CCCS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)CCCS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H23FN2O3S2/c1-18-7-5-10-22-24(18)27-25(32-22)28(17-19-8-3-2-4-9-19)23(29)11-6-16-33(30,31)21-14-12-20(26)13-15-21/h2-5,7-10,12-15H,6,11,16-17H2,1H3