8-chloranyl-5-(2-dimethylaminoethyl)-2-(4-methylsulfanylphenyl)-3-oxidanyl-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 8-chloranyl-5-(2-dimethylaminoethyl)-2-(4-methylsulfanylphenyl)-3-oxidanyl-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: 8-chloro-5-(2-dimethylaminoethyl)-3-hydroxy-2-(4-methylsulfanylphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: 8-chloro-5-(2-dimethylaminoethyl)-3-hydroxy-2-[4-(methylthio)phenyl]-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 8-chloro-5-(2-dimethylaminoethyl)-3-hydroxy-2-(4-methylsulfanylphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: 8-chloro-5-(2-dimethylaminoethyl)-3-hydroxy-2-[4-(methylthio)phenyl]-2,3-dihydro-1,5-benzothiazepin-4-one Formula: C20H23ClN2O2S2 MolecularWeight: 422.99182

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C2=C(C=C(C=C2)Cl)SC(C(C1=O)O)C3=CC=C(C=C3)SC

Isomeric SMILES

CN(C)CCN1C2=C(C=C(C=C2)Cl)SC(C(C1=O)O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C20H23ClN2O2S2/c1-22(2)10-11-23-16-9-6-14(21)12-17(16)27-19(18(24)20(23)25)13-4-7-15(26-3)8-5-13/h4-9,12,18-19,24H,10-11H2,1-3H3