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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)COC3=C(C=CC(=C3)C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)COC3=C(C=CC(=C3)C)C(C)C

InChI

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