2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone

Systemtic Name: 2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Openeye Name: 2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone CAS Name: 2-[[1-(2,4-dimethylphenyl)-2-imidazolyl]thio]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone IUPAC Name: 2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Traditional Name: 2-[[1-(2,4-dimethylphenyl)imidazol-2-yl]thio]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Formula: C23H25N3OS2 MolecularWeight: 423.5941

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)CSC3=NC=CN3C4=C(C=C(C=C4)C)C

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)CSC3=NC=CN3C4=C(C=C(C=C4)C)C

InChI

InChI=1S/C23H25N3OS2/c1-16-8-9-19(17(2)14-16)26-13-11-24-23(26)28-15-22(27)25-12-10-18(3)29-21-7-5-4-6-20(21)25/h4-9,11,13-14,18H,10,12,15H2,1-3H3