N-(3,5-dimethylphenyl)-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide Openeye Name: N-(3,5-dimethylphenyl)-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide CAS Name: N-(3,5-dimethylphenyl)-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide IUPAC Name: N-(3,5-dimethylphenyl)-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide Traditional Name: N-(3,5-dimethylphenyl)-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]valeramide Formula: C22H27N3O3S2 MolecularWeight: 445.59808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O3S2/c1-13(2)8-20(22(26)24-17-10-14(3)9-15(4)11-17)25-30(27,28)18-6-7-19-21(12-18)29-16(5)23-19/h6-7,9-13,20,25H,8H2,1-5H3,(H,24,26)