8-chloranyl-5-(2-dimethylaminoethyl)-3-methoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride

Systemtic Name: 8-chloranyl-5-(2-dimethylaminoethyl)-3-methoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride Openeye Name: 8-chloro-5-(2-dimethylaminoethyl)-3-methoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride CAS Name: 8-chloro-5-(2-dimethylaminoethyl)-3-methoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride IUPAC Name: 8-chloro-5-(2-dimethylaminoethyl)-3-methoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride Traditional Name: 8-chloro-5-(2-dimethylaminoethyl)-3-methoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride Formula: C21H26Cl2N2O3S MolecularWeight: 457.41374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN2O3S.ClH/c1-23(2)11-12-24-17-10-7-15(22)13-18(17)28-20(19(27-4)21(24)25)14-5-8-16(26-3)9-6-14;/h5-10,13,19-20H,11-12H2,1-4H3;1H