5-(3,4-diethoxyphenyl)sulfonyl-3,4-dihydro-2H-1,5-benzothiazepine

Systemtic Name: 5-(3,4-diethoxyphenyl)sulfonyl-3,4-dihydro-2H-1,5-benzothiazepine Openeye Name: 5-(3,4-diethoxyphenyl)sulfonyl-3,4-dihydro-2H-1,5-benzothiazepine CAS Name: 5-(3,4-diethoxyphenyl)sulfonyl-3,4-dihydro-2H-1,5-benzothiazepine IUPAC Name: 5-(3,4-diethoxyphenyl)sulfonyl-3,4-dihydro-2H-1,5-benzothiazepine Traditional Name: 5-(3,4-diethoxyphenyl)sulfonyl-3,4-dihydro-2H-1,5-benzothiazepine Formula: C19H23NO4S2 MolecularWeight: 393.52022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCSC3=CC=CC=C32)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCSC3=CC=CC=C32)OCC

InChI

InChI=1S/C19H23NO4S2/c1-3-23-17-11-10-15(14-18(17)24-4-2)26(21,22)20-12-7-13-25-19-9-6-5-8-16(19)20/h5-6,8-11,14H,3-4,7,12-13H2,1-2H3