2-acetamido-3-(4-fluorophenyl)-N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]propanamide

Systemtic Name: 2-acetamido-3-(4-fluorophenyl)-N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]propanamide Openeye Name: 2-acetamido-3-(4-fluorophenyl)-N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]propanamide CAS Name: 2-acetamido-3-(4-fluorophenyl)-N-[2-[(3-methoxy-3-methylbutyl)thio]-1,3-benzothiazol-6-yl]propanamide IUPAC Name: 2-acetamido-3-(4-fluorophenyl)-N-[2-(3-methoxy-3-methylbutyl)sulfanyl-1,3-benzothiazol-6-yl]propanamide Traditional Name: 2-acetamido-3-(4-fluorophenyl)-N-[2-[(3-methoxy-3-methyl-butyl)thio]-1,3-benzothiazol-6-yl]propionamide Formula: C24H28FN3O3S2 MolecularWeight: 489.625823

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=C(C=C1)F)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCCC(C)(C)OC

Isomeric SMILES

CC(=O)NC(CC1=CC=C(C=C1)F)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCCC(C)(C)OC

InChI

InChI=1S/C24H28FN3O3S2/c1-15(29)26-20(13-16-5-7-17(25)8-6-16)22(30)27-18-9-10-19-21(14-18)33-23(28-19)32-12-11-24(2,3)31-4/h5-10,14,20H,11-13H2,1-4H3,(H,26,29)(H,27,30)