1-(4-tert-butylphenyl)-3-[5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea

Systemtic Name: 1-(4-tert-butylphenyl)-3-[5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-(4-tert-butylphenyl)-3-[5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea CAS Name: 1-(4-tert-butylphenyl)-3-[5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-(4-tert-butylphenyl)-3-[5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-(4-tert-butylphenyl)-3-[5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC2=NN=C(S2)NC(=O)NC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)OCC2=NN=C(S2)NC(=O)NC3=CC=C(C=C3)C(C)(C)C

InChI

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