N',N'-diethyl-N-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]ethane-1,2-diamine

Systemtic Name: N',N'-diethyl-N-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]ethane-1,2-diamine Openeye Name: N',N'-diethyl-N-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]ethane-1,2-diamine CAS Name: N',N'-diethyl-N-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]ethane-1,2-diamine IUPAC Name: N',N'-diethyl-N-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]ethane-1,2-diamine Traditional Name: diethyl-[2-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]amino]ethyl]amine Formula: C14H18F3N3S MolecularWeight: 317.37303

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=NC2=C(S1)C=CC(=C2)C(F)(F)F

Isomeric SMILES

CCN(CC)CCNC1=NC2=C(S1)C=CC(=C2)C(F)(F)F

InChI

InChI=1S/C14H18F3N3S/c1-3-20(4-2)8-7-18-13-19-11-9-10(14(15,16)17)5-6-12(11)21-13/h5-6,9H,3-4,7-8H2,1-2H3,(H,18,19)