1-[4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethoxy]phenyl]propan-1-one Openeye Name: 1-[4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxo-ethoxy]phenyl]propan-1-one CAS Name: 1-[4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethoxy]phenyl]propan-1-one Traditional Name: 1-[4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-keto-ethoxy]phenyl]propan-1-one Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(=O)N2CCCSC3=CC=CC=C32

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(=O)N2CCCSC3=CC=CC=C32

InChI

InChI=1S/C20H21NO3S/c1-2-18(22)15-8-10-16(11-9-15)24-14-20(23)21-12-5-13-25-19-7-4-3-6-17(19)21/h3-4,6-11H,2,5,12-14H2,1H3