4-(4-methylphenyl)sulfonyl-N-(6-propan-2-yl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-(4-methylphenyl)sulfonyl-N-(6-propan-2-yl-1,3-benzothiazol-2-yl)butanamide Openeye Name: N-(6-isopropyl-1,3-benzothiazol-2-yl)-4-(p-tolylsulfonyl)butanamide CAS Name: 4-(4-methylphenyl)sulfonyl-N-(6-propan-2-yl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-(4-methylphenyl)sulfonyl-N-(6-propan-2-yl-1,3-benzothiazol-2-yl)butanamide Traditional Name: N-(6-isopropyl-1,3-benzothiazol-2-yl)-4-tosyl-butyramide Formula: C21H24N2O3S2 MolecularWeight: 416.55686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCCC(=O)NC2=NC3=C(S2)C=C(C=C3)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCCC(=O)NC2=NC3=C(S2)C=C(C=C3)C(C)C

InChI

InChI=1S/C21H24N2O3S2/c1-14(2)16-8-11-18-19(13-16)27-21(22-18)23-20(24)5-4-12-28(25,26)17-9-6-15(3)7-10-17/h6-11,13-14H,4-5,12H2,1-3H3,(H,22,23,24)