2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-3-methyl-N-(3-propan-2-ylphenyl)butanamide

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-3-methyl-N-(3-propan-2-ylphenyl)butanamide Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(3-isopropylphenyl)-3-methyl-butanamide CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-N-(3-propan-2-ylphenyl)butanamide IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-N-(3-propan-2-ylphenyl)butanamide Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-m-cumenyl-3-methyl-butyramide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)NC(=O)C(C(C)C)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CC(C)C1=CC(=CC=C1)NC(=O)C(C(C)C)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C21H25N3O3S/c1-13(2)15-8-7-9-16(12-15)22-21(25)19(14(3)4)23-20-17-10-5-6-11-18(17)28(26,27)24-20/h5-14,19H,1-4H3,(H,22,25)(H,23,24)