7-chloranyl-5-(2-chloranylethanoyl)-3,8-dimethoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 7-chloranyl-5-(2-chloranylethanoyl)-3,8-dimethoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: 7-chloro-5-(2-chloroacetyl)-3,8-dimethoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: 7-chloro-5-(2-chloro-1-oxoethyl)-3,8-dimethoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 7-chloro-5-(2-chloroacetyl)-3,8-dimethoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: 7-chloro-5-(2-chloroacetyl)-3,8-dimethoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one Formula: C20H19Cl2NO5S MolecularWeight: 456.33956

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(SC2=CC(=C(C=C2N(C1=O)C(=O)CCl)Cl)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

COC1C(SC2=CC(=C(C=C2N(C1=O)C(=O)CCl)Cl)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H19Cl2NO5S/c1-26-12-6-4-11(5-7-12)19-18(28-3)20(25)23(17(24)10-21)14-8-13(22)15(27-2)9-16(14)29-19/h4-9,18-19H,10H2,1-3H3