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

Systemtic Name: 1-[5-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-phenyl-urea Openeye Name: 1-[5-[(2-isopropyl-5-methyl-phenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-phenyl-urea CAS Name: 1-[5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-phenylurea IUPAC Name: 1-[5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-phenylurea Traditional Name: 1-[5-[(2-isopropyl-5-methyl-phenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-phenyl-urea Formula: C20H22N4O2S MolecularWeight: 382.47928

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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=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O2S/c1-13(2)16-10-9-14(3)11-17(16)26-12-18-23-24-20(27-18)22-19(25)21-15-7-5-4-6-8-15/h4-11,13H,12H2,1-3H3,(H2,21,22,24,25)