1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-(4-methylphenyl)sulfonyl-propan-1-one

Systemtic Name: 1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-(4-methylphenyl)sulfonyl-propan-1-one Openeye Name: 1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-(p-tolylsulfonyl)propan-1-one CAS Name: 1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-(4-methylphenyl)sulfonyl-1-propanone IUPAC Name: 1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-(4-methylphenyl)sulfonylpropan-1-one Traditional Name: 1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-tosyl-propan-1-one Formula: C20H23NO3S2 MolecularWeight: 389.53152

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H23NO3S2/c1-15-7-9-17(10-8-15)26(23,24)14-12-20(22)21-13-11-16(2)25-19-6-4-3-5-18(19)21/h3-10,16H,11-14H2,1-2H3