N,2-diethyl-1-oxidanylidene-4-(3-phenethyloxypropylsulfonyl)-2H-1,3-benzothiazol-3-amine

Systemtic Name: N,2-diethyl-1-oxidanylidene-4-(3-phenethyloxypropylsulfonyl)-2H-1,3-benzothiazol-3-amine Openeye Name: N,2-diethyl-1-oxo-4-(3-phenethyloxypropylsulfonyl)-2H-1,3-benzothiazol-3-amine CAS Name: N,2-diethyl-1-oxo-4-(3-phenethyloxypropylsulfonyl)-2H-1,3-benzothiazol-3-amine IUPAC Name: N,2-diethyl-1-oxo-4-(3-phenethyloxypropylsulfonyl)-2H-1,3-benzothiazol-3-amine Traditional Name: ethyl-[2-ethyl-1-keto-4-(3-phenethyloxypropylsulfonyl)-2H-1,3-benzothiazol-3-yl]amine Formula: C22H30N2O4S2 MolecularWeight: 450.6146

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Descriptors Computed from Structure

Canonical SMILES:

CCC1N(C2=C(S1=O)C=CC=C2S(=O)(=O)CCCOCCC3=CC=CC=C3)NCC

Isomeric SMILES

CCC1N(C2=C(S1=O)C=CC=C2S(=O)(=O)CCCOCCC3=CC=CC=C3)NCC

InChI

InChI=1S/C22H30N2O4S2/c1-3-21-24(23-4-2)22-19(29(21)25)12-8-13-20(22)30(26,27)17-9-15-28-16-14-18-10-6-5-7-11-18/h5-8,10-13,21,23H,3-4,9,14-17H2,1-2H3