S-(2-diethylaminoethyl) 4-azanyl-2-(2-methylpropoxy)benzenecarbothioate hydrochloride

Systemtic Name: S-(2-diethylaminoethyl) 4-azanyl-2-(2-methylpropoxy)benzenecarbothioate hydrochloride Openeye Name: S-(2-diethylaminoethyl) 4-amino-2-isobutoxy-benzenecarbothioate hydrochloride CAS Name: 4-amino-2-(2-methylpropoxy)benzenecarbothioic acid S-(2-diethylaminoethyl) ester hydrochloride IUPAC Name: S-(2-diethylaminoethyl) 4-amino-2-(2-methylpropoxy)benzenecarbothioate hydrochloride Traditional Name: 4-amino-2-isobutoxy-thiobenzoic acid S-(2-diethylaminoethyl) ester hydrochloride Formula: C17H29ClN2O2S MolecularWeight: 360.94236

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC(=O)C1=C(C=C(C=C1)N)OCC(C)C.Cl

Isomeric SMILES

CCN(CC)CCSC(=O)C1=C(C=C(C=C1)N)OCC(C)C.Cl

InChI

InChI=1S/C17H28N2O2S.ClH/c1-5-19(6-2)9-10-22-17(20)15-8-7-14(18)11-16(15)21-12-13(3)4;/h7-8,11,13H,5-6,9-10,12,18H2,1-4H3;1H