N-(6-bromanyl-3-methyl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazol-2-ylidene)-4-cyano-benzamide

Systemtic Name: N-(6-bromanyl-3-methyl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazol-2-ylidene)-4-cyano-benzamide Openeye Name: N-(6-bromo-3-methyl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazol-2-ylidene)-4-cyano-benzamide CAS Name: N-(6-bromo-3-methyl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazol-2-ylidene)-4-cyanobenzamide IUPAC Name: N-(6-bromo-3-methyl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazol-2-ylidene)-4-cyanobenzamide Traditional Name: N-(6-bromo-3-methyl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazol-2-ylidene)-4-cyano-benzamide Formula: C16H16BrN3OS MolecularWeight: 378.28674

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC(CC2SC1=NC(=O)C3=CC=C(C=C3)C#N)Br

Isomeric SMILES

CN1C2CCC(CC2SC1=NC(=O)C3=CC=C(C=C3)C#N)Br

InChI

InChI=1S/C16H16BrN3OS/c1-20-13-7-6-12(17)8-14(13)22-16(20)19-15(21)11-4-2-10(9-18)3-5-11/h2-5,12-14H,6-8H2,1H3