butan-2-yl (NE)-N-(1-methyl-1-oxidanylidene-1,2-benzothiazol-3-ylidene)carbamate

Systemtic Name: butan-2-yl (NE)-N-(1-methyl-1-oxidanylidene-1,2-benzothiazol-3-ylidene)carbamate Openeye Name: sec-butyl (NE)-N-(1-methyl-1-oxo-1,2-benzothiazol-3-ylidene)carbamate CAS Name: (NE)-N-(1-methyl-1-oxo-1,2-benzothiazol-3-ylidene)carbamic acid butan-2-yl ester IUPAC Name: butan-2-yl (NE)-N-(1-methyl-1-oxo-1,2-benzothiazol-3-ylidene)carbamate Traditional Name: (NE)-N-(1-keto-1-methyl-1,2-benzothiazol-3-ylidene)carbamic acid sec-butyl ester Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)N=C1C2=CC=CC=C2S(=N1)(=O)C

Isomeric SMILES

CCC(C)OC(=O)/N=C/1\C2=CC=CC=C2S(=N1)(=O)C

InChI

InChI=1S/C13H16N2O3S/c1-4-9(2)18-13(16)14-12-10-7-5-6-8-11(10)19(3,17)15-12/h5-9H,4H2,1-3H3/b14-12+