N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-4-thiophen-2-yl-butanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-4-thiophen-2-yl-butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-4-(2-thienyl)butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-4-thiophen-2-ylbutanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-4-thiophen-2-ylbutanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-4-(2-thienyl)butyramide Formula: C23H22N2OS2 MolecularWeight: 406.56358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCCC4=CC=CS4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCCC4=CC=CS4)C

InChI

InChI=1S/C23H22N2OS2/c1-16-13-17(2)15-18(14-16)25(22(26)11-5-7-19-8-6-12-27-19)23-24-20-9-3-4-10-21(20)28-23/h3-4,6,8-10,12-15H,5,7,11H2,1-2H3