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

Systemtic Name: N-(6-bromanyl-3-methyl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazol-2-ylidene)-4-phenyl-benzamide Openeye Name: N-(6-bromo-3-methyl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazol-2-ylidene)-4-phenyl-benzamide CAS Name: N-(6-bromo-3-methyl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide IUPAC Name: N-(6-bromo-3-methyl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide Traditional Name: N-(6-bromo-3-methyl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazol-2-ylidene)-4-phenyl-benzamide Formula: C21H21BrN2OS MolecularWeight: 429.37324

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC(CC2SC1=NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)Br

Isomeric SMILES

CN1C2CCC(CC2SC1=NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)Br

InChI

InChI=1S/C21H21BrN2OS/c1-24-18-12-11-17(22)13-19(18)26-21(24)23-20(25)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-10,17-19H,11-13H2,1H3