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

Systemtic Name: (2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-3-methyl-N-phenylmethoxy-butanamide Openeye Name: (2S)-N-benzyloxy-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-butanamide CAS Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-N-phenylmethoxybutanamide IUPAC Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-N-phenylmethoxybutanamide Traditional Name: (2S)-N-benzoxy-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-3-methyl-butyramide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NOCC1=CC=CC=C1)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CC(C)[C@@H](C(=O)NOCC1=CC=CC=C1)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H21N3O4S/c1-13(2)17(19(23)21-26-12-14-8-4-3-5-9-14)20-18-15-10-6-7-11-16(15)27(24,25)22-18/h3-11,13,17H,12H2,1-2H3,(H,20,22)(H,21,23)/t17-/m0/s1