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

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-3-methyl-N-(2-pyridin-2-ylethyl)butanamide Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-N-[2-(2-pyridyl)ethyl]butanamide CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-N-[2-(2-pyridinyl)ethyl]butanamide IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-N-(2-pyridin-2-ylethyl)butanamide Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-3-methyl-N-[2-(2-pyridyl)ethyl]butyramide Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCC1=CC=CC=N1)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CC(C)C(C(=O)NCCC1=CC=CC=N1)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H22N4O3S/c1-13(2)17(19(24)21-12-10-14-7-5-6-11-20-14)22-18-15-8-3-4-9-16(15)27(25,26)23-18/h3-9,11,13,17H,10,12H2,1-2H3,(H,21,24)(H,22,23)