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

Systemtic Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(4-morpholin-4-ylsulfonylphenyl)methanone Openeye Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(4-morpholinosulfonylphenyl)methanone CAS Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[4-(4-morpholinylsulfonyl)phenyl]methanone IUPAC Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(4-morpholin-4-ylsulfonylphenyl)methanone Traditional Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(4-morpholinosulfonylphenyl)methanone Formula: C20H22N2O4S2 MolecularWeight: 418.52968

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H22N2O4S2/c23-20(22-10-3-15-27-19-5-2-1-4-18(19)22)16-6-8-17(9-7-16)28(24,25)21-11-13-26-14-12-21/h1-2,4-9H,3,10-15H2