2-ethyl-4-ethylsulfonyl-1-oxidanylidene-5-phenethyloxy-N-propyl-2H-1,3-benzothiazol-3-amine hydrochloride

Systemtic Name: 2-ethyl-4-ethylsulfonyl-1-oxidanylidene-5-phenethyloxy-N-propyl-2H-1,3-benzothiazol-3-amine hydrochloride Openeye Name: 2-ethyl-4-ethylsulfonyl-1-oxo-5-phenethyloxy-N-propyl-2H-1,3-benzothiazol-3-amine hydrochloride CAS Name: 2-ethyl-4-ethylsulfonyl-1-oxo-5-phenethyloxy-N-propyl-2H-1,3-benzothiazol-3-amine hydrochloride IUPAC Name: 2-ethyl-4-ethylsulfonyl-1-oxo-5-phenethyloxy-N-propyl-2H-1,3-benzothiazol-3-amine hydrochloride Traditional Name: (4-esyl-2-ethyl-1-keto-5-phenethyloxy-2H-1,3-benzothiazol-3-yl)-propyl-amine hydrochloride Formula: C22H31ClN2O4S2 MolecularWeight: 487.07554

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Descriptors Computed from Structure

Canonical SMILES:

CCCNN1C(S(=O)C2=C1C(=C(C=C2)OCCC3=CC=CC=C3)S(=O)(=O)CC)CC.Cl

Isomeric SMILES

CCCNN1C(S(=O)C2=C1C(=C(C=C2)OCCC3=CC=CC=C3)S(=O)(=O)CC)CC.Cl

InChI

InChI=1S/C22H30N2O4S2.ClH/c1-4-15-23-24-20(5-2)29(25)19-13-12-18(22(21(19)24)30(26,27)6-3)28-16-14-17-10-8-7-9-11-17;/h7-13,20,23H,4-6,14-16H2,1-3H3;1H