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

Systemtic Name: 1-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea Openeye Name: 1-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea CAS Name: 1-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea IUPAC Name: 1-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea Traditional Name: 1-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-p-phenetyl-urea Formula: C21H24N4O3S MolecularWeight: 412.50526

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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)OCC

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O3S/c1-3-5-13-28-18-8-6-7-15(14-18)19-24-25-21(29-19)23-20(26)22-16-9-11-17(12-10-16)27-4-2/h6-12,14H,3-5,13H2,1-2H3,(H2,22,23,25,26)