2-[4-[5-chloranyl-2-(phenylmethyl)sulfonyl-phenyl]-1,3-thiazol-2-yl]ethanamine

Systemtic Name: 2-[4-[5-chloranyl-2-(phenylmethyl)sulfonyl-phenyl]-1,3-thiazol-2-yl]ethanamine Openeye Name: 2-[4-(2-benzylsulfonyl-5-chloro-phenyl)thiazol-2-yl]ethanamine CAS Name: 2-[4-[5-chloro-2-(phenylmethyl)sulfonylphenyl]-2-thiazolyl]ethanamine IUPAC Name: 2-[4-(2-benzylsulfonyl-5-chlorophenyl)-1,3-thiazol-2-yl]ethanamine Traditional Name: 2-[4-(2-benzylsulfonyl-5-chloro-phenyl)thiazol-2-yl]ethylamine Formula: C18H17ClN2O2S2 MolecularWeight: 392.92278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)C2=C(C=C(C=C2)Cl)C3=CSC(=N3)CCN

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)C2=C(C=C(C=C2)Cl)C3=CSC(=N3)CCN

InChI

InChI=1S/C18H17ClN2O2S2/c19-14-6-7-17(25(22,23)12-13-4-2-1-3-5-13)15(10-14)16-11-24-18(21-16)8-9-20/h1-7,10-11H,8-9,12,20H2