S-[3-(diethylamino)propyl] 4-azanyl-2-ethoxy-benzenecarbothioate hydrochloride

Systemtic Name: S-[3-(diethylamino)propyl] 4-azanyl-2-ethoxy-benzenecarbothioate hydrochloride Openeye Name: S-[3-(diethylamino)propyl] 4-amino-2-ethoxy-benzenecarbothioate hydrochloride CAS Name: 4-amino-2-ethoxybenzenecarbothioic acid S-[3-(diethylamino)propyl] ester hydrochloride IUPAC Name: S-[3-(diethylamino)propyl] 4-amino-2-ethoxybenzenecarbothioate hydrochloride Traditional Name: 4-amino-2-ethoxy-thiobenzoic acid S-[3-(diethylamino)propyl] ester hydrochloride Formula: C16H27ClN2O2S MolecularWeight: 346.91578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O2S.ClH/c1-4-18(5-2)10-7-11-21-16(19)14-9-8-13(17)12-15(14)20-6-3;/h8-9,12H,4-7,10-11,17H2,1-3H3;1H