N-(2-dimethylaminoethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-phenylsulfanyl-propanamide hydrochloride

Systemtic Name: N-(2-dimethylaminoethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-phenylsulfanyl-propanamide hydrochloride Openeye Name: N-(2-dimethylaminoethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-phenylsulfanyl-propanamide hydrochloride CAS Name: N-(2-dimethylaminoethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(phenylthio)propanamide hydrochloride IUPAC Name: N-(2-dimethylaminoethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-phenylsulfanylpropanamide hydrochloride Traditional Name: N-(2-dimethylaminoethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(phenylthio)propionamide hydrochloride Formula: C22H28ClN3O2S2 MolecularWeight: 466.05962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N(CCN(C)C)C(=O)CCSC3=CC=CC=C3.Cl

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N(CCN(C)C)C(=O)CCSC3=CC=CC=C3.Cl

InChI

InChI=1S/C22H27N3O2S2.ClH/c1-4-27-17-10-11-19-20(16-17)29-22(23-19)25(14-13-24(2)3)21(26)12-15-28-18-8-6-5-7-9-18;/h5-11,16H,4,12-15H2,1-3H3;1H