methanesulfonic acid; N-phenethyl-4-phenyl-1,3-thiazol-2-amine

Systemtic Name: methanesulfonic acid; N-phenethyl-4-phenyl-1,3-thiazol-2-amine Openeye Name: methanesulfonic acid; N-phenethyl-4-phenyl-thiazol-2-amine CAS Name: methanesulfonic acid; N-phenethyl-4-phenyl-2-thiazolamine IUPAC Name: methanesulfonic acid; N-phenethyl-4-phenyl-1,3-thiazol-2-amine Traditional Name: mesylic acid; phenethyl-(4-phenylthiazol-2-yl)amine Formula: C18H20N2O3S2 MolecularWeight: 376.493

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1=CC=C(C=C1)CCNC2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)O.C1=CC=C(C=C1)CCNC2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C17H16N2S.CH4O3S/c1-3-7-14(8-4-1)11-12-18-17-19-16(13-20-17)15-9-5-2-6-10-15;1-5(2,3)4/h1-10,13H,11-12H2,(H,18,19);1H3,(H,2,3,4)