2-[4-[4-(phenylmethyl)sulfonylphenyl]-1,3-thiazol-2-yl]ethanamine

Systemtic Name: 2-[4-[4-(phenylmethyl)sulfonylphenyl]-1,3-thiazol-2-yl]ethanamine Openeye Name: 2-[4-(4-benzylsulfonylphenyl)thiazol-2-yl]ethanamine CAS Name: 2-[4-[4-(phenylmethyl)sulfonylphenyl]-2-thiazolyl]ethanamine IUPAC Name: 2-[4-(4-benzylsulfonylphenyl)-1,3-thiazol-2-yl]ethanamine Traditional Name: 2-[4-(4-benzylsulfonylphenyl)thiazol-2-yl]ethylamine Formula: C18H18N2O2S2 MolecularWeight: 358.47772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O2S2/c19-11-10-18-20-17(12-23-18)15-6-8-16(9-7-15)24(21,22)13-14-4-2-1-3-5-14/h1-9,12H,10-11,13,19H2