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

Systemtic Name: N,2-diethyl-1-oxidanylidene-4-(1-phenethyloxypropylsulfonyl)-2H-1,3-benzothiazol-3-amine Openeye Name: N,2-diethyl-1-oxo-4-(1-phenethyloxypropylsulfonyl)-2H-1,3-benzothiazol-3-amine CAS Name: N,2-diethyl-1-oxo-4-(1-phenethyloxypropylsulfonyl)-2H-1,3-benzothiazol-3-amine IUPAC Name: N,2-diethyl-1-oxo-4-(1-phenethyloxypropylsulfonyl)-2H-1,3-benzothiazol-3-amine Traditional Name: ethyl-[2-ethyl-1-keto-4-(1-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)C(CC)OCCC3=CC=CC=C3)NCC

Isomeric SMILES

CCC1N(C2=C(S1=O)C=CC=C2S(=O)(=O)C(CC)OCCC3=CC=CC=C3)NCC

InChI

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