N,N-dimethyl-2-[[4-[2-(3-nitrophenyl)-1,3-thiazol-5-yl]phenyl]methylsulfanyl]ethanamine

Systemtic Name: N,N-dimethyl-2-[[4-[2-(3-nitrophenyl)-1,3-thiazol-5-yl]phenyl]methylsulfanyl]ethanamine Openeye Name: N,N-dimethyl-2-[[4-[2-(3-nitrophenyl)thiazol-5-yl]phenyl]methylsulfanyl]ethanamine CAS Name: N,N-dimethyl-2-[[4-[2-(3-nitrophenyl)-5-thiazolyl]phenyl]methylthio]ethanamine IUPAC Name: N,N-dimethyl-2-[[4-[2-(3-nitrophenyl)-1,3-thiazol-5-yl]phenyl]methylsulfanyl]ethanamine Traditional Name: dimethyl-[2-[[4-[2-(3-nitrophenyl)thiazol-5-yl]benzyl]thio]ethyl]amine Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSCC1=CC=C(C=C1)C2=CN=C(S2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCSCC1=CC=C(C=C1)C2=CN=C(S2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O2S2/c1-22(2)10-11-26-14-15-6-8-16(9-7-15)19-13-21-20(27-19)17-4-3-5-18(12-17)23(24)25/h3-9,12-13H,10-11,14H2,1-2H3