4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1-ethyl-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1-ethylbenzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CN4CCCSC5=CC=CC=C54

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CN4CCCSC5=CC=CC=C54

InChI

InChI=1S/C23H28N4O3S2/c1-2-27-20-9-8-18(32(28,29)26-11-13-30-14-12-26)16-19(20)24-23(27)17-25-10-5-15-31-22-7-4-3-6-21(22)25/h3-4,6-9,16H,2,5,10-15,17H2,1H3