1-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-(4-methylphenyl)urea

Systemtic Name: 1-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-(4-methylphenyl)urea Openeye Name: 1-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-(p-tolyl)urea CAS Name: 1-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-(4-methylphenyl)urea IUPAC Name: 1-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-(4-methylphenyl)urea Traditional Name: 1-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-(p-tolyl)urea Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C20H22N4O2S/c1-3-4-12-26-17-7-5-6-15(13-17)18-23-24-20(27-18)22-19(25)21-16-10-8-14(2)9-11-16/h5-11,13H,3-4,12H2,1-2H3,(H2,21,22,24,25)