3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(4-methylsulfonylphenyl)methanone

Systemtic Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(4-methylsulfonylphenyl)methanone Openeye Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(4-methylsulfonylphenyl)methanone CAS Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(4-methylsulfonylphenyl)methanone IUPAC Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(4-methylsulfonylphenyl)methanone Traditional Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(4-mesylphenyl)methanone Formula: C17H17NO3S2 MolecularWeight: 347.45178

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCCSC3=CC=CC=C32

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCCSC3=CC=CC=C32

InChI

InChI=1S/C17H17NO3S2/c1-23(20,21)14-9-7-13(8-10-14)17(19)18-11-4-12-22-16-6-3-2-5-15(16)18/h2-3,5-10H,4,11-12H2,1H3