N-(3,5-dimethylphenyl)-3-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]butanamide

Systemtic Name: N-(3,5-dimethylphenyl)-3-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]butanamide Openeye Name: N-(3,5-dimethylphenyl)-3-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]butanamide CAS Name: N-(3,5-dimethylphenyl)-3-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]butanamide IUPAC Name: N-(3,5-dimethylphenyl)-3-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]butanamide Traditional Name: N-(3,5-dimethylphenyl)-3-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]butyramide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C(C(C)C)NS(=O)(=O)C2=CC3=C(C=C2)N=C(S3)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C(C(C)C)NS(=O)(=O)C2=CC3=C(C=C2)N=C(S3)C)C

InChI

InChI=1S/C21H25N3O3S2/c1-12(2)20(21(25)23-16-9-13(3)8-14(4)10-16)24-29(26,27)17-6-7-18-19(11-17)28-15(5)22-18/h6-12,20,24H,1-5H3,(H,23,25)