N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-phenylsulfanyl-propanamide hydrochloride

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-phenylsulfanyl-propanamide hydrochloride Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-phenylsulfanyl-propanamide hydrochloride CAS Name: N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-(phenylthio)propanamide hydrochloride IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-phenylsulfanylpropanamide hydrochloride Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-(phenylthio)propionamide hydrochloride Formula: C22H28ClN3OS2 MolecularWeight: 450.06022

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=CC=CC=C2S1)C(=O)CCSC3=CC=CC=C3.Cl

Isomeric SMILES

CCN(CC)CCN(C1=NC2=CC=CC=C2S1)C(=O)CCSC3=CC=CC=C3.Cl

InChI

InChI=1S/C22H27N3OS2.ClH/c1-3-24(4-2)15-16-25(22-23-19-12-8-9-13-20(19)28-22)21(26)14-17-27-18-10-6-5-7-11-18;/h5-13H,3-4,14-17H2,1-2H3;1H