5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-7,8-dimethyl-3-oxidanyl-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-7,8-dimethyl-3-oxidanyl-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: 5-(2-dimethylaminoethyl)-3-hydroxy-2-(4-methoxyphenyl)-7,8-dimethyl-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: 5-(2-dimethylaminoethyl)-3-hydroxy-2-(4-methoxyphenyl)-7,8-dimethyl-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 5-(2-dimethylaminoethyl)-3-hydroxy-2-(4-methoxyphenyl)-7,8-dimethyl-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: 5-(2-dimethylaminoethyl)-3-hydroxy-2-(4-methoxyphenyl)-7,8-dimethyl-2,3-dihydro-1,5-benzothiazepin-4-one Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(C(C(=O)N2CCN(C)C)O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(C(C(=O)N2CCN(C)C)O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H28N2O3S/c1-14-12-18-19(13-15(14)2)28-21(16-6-8-17(27-5)9-7-16)20(25)22(26)24(18)11-10-23(3)4/h6-9,12-13,20-21,25H,10-11H2,1-5H3