ethyl N-(6-methyl-4-thiocyanato-1,3-benzothiazol-2-yl)carbamate

Systemtic Name: ethyl N-(6-methyl-4-thiocyanato-1,3-benzothiazol-2-yl)carbamate Openeye Name: ethyl N-(6-methyl-4-thiocyanato-1,3-benzothiazol-2-yl)carbamate CAS Name: N-(6-methyl-4-thiocyanato-1,3-benzothiazol-2-yl)carbamic acid ethyl ester IUPAC Name: ethyl N-(6-methyl-4-thiocyanato-1,3-benzothiazol-2-yl)carbamate Traditional Name: N-(6-methyl-4-thiocyanato-1,3-benzothiazol-2-yl)carbamic acid ethyl ester Formula: C12H11N3O2S2 MolecularWeight: 293.36464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=NC2=C(S1)C=C(C=C2SC#N)C

Isomeric SMILES

CCOC(=O)NC1=NC2=C(S1)C=C(C=C2SC#N)C

InChI

InChI=1S/C12H11N3O2S2/c1-3-17-12(16)15-11-14-10-8(18-6-13)4-7(2)5-9(10)19-11/h4-5H,3H2,1-2H3,(H,14,15,16)