ethanedioic acid; 3-methyl-5-[1-[1-(2-methylphenyl)ethylamino]ethyl]-4-phenyl-1,3-thiazol-2-one

Systemtic Name: ethanedioic acid; 3-methyl-5-[1-[1-(2-methylphenyl)ethylamino]ethyl]-4-phenyl-1,3-thiazol-2-one Openeye Name: 3-methyl-5-[1-[1-(o-tolyl)ethylamino]ethyl]-4-phenyl-thiazol-2-one; oxalic acid CAS Name: 3-methyl-5-[1-[1-(2-methylphenyl)ethylamino]ethyl]-4-phenyl-2-thiazolone; oxalic acid IUPAC Name: 3-methyl-5-[1-[1-(2-methylphenyl)ethylamino]ethyl]-4-phenyl-1,3-thiazol-2-one; oxalic acid Traditional Name: 3-methyl-5-[1-[1-(o-tolyl)ethylamino]ethyl]-4-phenyl-4-thiazolin-2-one; oxalic acid Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C)NC(C)C2=C(N(C(=O)S2)C)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=CC=C1C(C)NC(C)C2=C(N(C(=O)S2)C)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H24N2OS.C2H2O4/c1-14-10-8-9-13-18(14)15(2)22-16(3)20-19(23(4)21(24)25-20)17-11-6-5-7-12-17;3-1(4)2(5)6/h5-13,15-16,22H,1-4H3;(H,3,4)(H,5,6)