4-[[5-chloranyl-7-(trifluoromethyl)-2,1-benzothiazol-3-yl]diazenyl]-N-ethyl-2,5-dimethoxy-aniline

Systemtic Name: 4-[[5-chloranyl-7-(trifluoromethyl)-2,1-benzothiazol-3-yl]diazenyl]-N-ethyl-2,5-dimethoxy-aniline Openeye Name: 4-[[5-chloro-7-(trifluoromethyl)-2,1-benzothiazol-3-yl]azo]-N-ethyl-2,5-dimethoxy-aniline CAS Name: 4-[[5-chloro-7-(trifluoromethyl)-2,1-benzothiazol-3-yl]azo]-N-ethyl-2,5-dimethoxyaniline IUPAC Name: 4-[[5-chloro-7-(trifluoromethyl)-2,1-benzothiazol-3-yl]diazenyl]-N-ethyl-2,5-dimethoxyaniline Traditional Name: [4-[[5-chloro-7-(trifluoromethyl)-2,1-benzothiazol-3-yl]azo]-2,5-dimethoxy-phenyl]-ethyl-amine Formula: C18H16ClF3N4O2S MolecularWeight: 444.85845

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C(=C1)OC)N=NC2=C3C=C(C=C(C3=NS2)C(F)(F)F)Cl)OC

Isomeric SMILES

CCNC1=C(C=C(C(=C1)OC)N=NC2=C3C=C(C=C(C3=NS2)C(F)(F)F)Cl)OC

InChI

InChI=1S/C18H16ClF3N4O2S/c1-4-23-12-7-15(28-3)13(8-14(12)27-2)24-25-17-10-5-9(19)6-11(18(20,21)22)16(10)26-29-17/h5-8,23H,4H2,1-3H3