5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-6,7-dimethyl-3-oxidanyl-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-6,7-dimethyl-3-oxidanyl-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: 5-(2-dimethylaminoethyl)-3-hydroxy-2-(4-methoxyphenyl)-6,7-dimethyl-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: 5-(2-dimethylaminoethyl)-3-hydroxy-2-(4-methoxyphenyl)-6,7-dimethyl-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 5-(2-dimethylaminoethyl)-3-hydroxy-2-(4-methoxyphenyl)-6,7-dimethyl-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: 5-(2-dimethylaminoethyl)-3-hydroxy-2-(4-methoxyphenyl)-6,7-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=C(C2=C(C=C1)SC(C(C(=O)N2CCN(C)C)O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(C(C(=O)N2CCN(C)C)O)C3=CC=C(C=C3)OC)C

InChI

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