1-(2-methylphenyl)-3-[5-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea

Systemtic Name: 1-(2-methylphenyl)-3-[5-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-[5-[(2-isopropyl-5-methyl-phenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(o-tolyl)urea CAS Name: 1-(2-methylphenyl)-3-[5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-(2-methylphenyl)-3-[5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-[5-[(2-isopropyl-5-methyl-phenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(o-tolyl)urea Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC2=NN=C(S2)NC(=O)NC3=CC=CC=C3C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC2=NN=C(S2)NC(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C21H24N4O2S/c1-13(2)16-10-9-14(3)11-18(16)27-12-19-24-25-21(28-19)23-20(26)22-17-8-6-5-7-15(17)4/h5-11,13H,12H2,1-4H3,(H2,22,23,25,26)