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

Systemtic Name: 1-(4-ethoxyphenyl)-3-[5-[(3-methylphenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-(4-ethoxyphenyl)-3-[5-(m-tolylmethylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]urea CAS Name: 1-(4-ethoxyphenyl)-3-[5-[[(3-methylphenyl)methylthio]methyl]-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-(4-ethoxyphenyl)-3-[5-[(3-methylphenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-[5-[[(3-methylbenzyl)thio]methyl]-1,3,4-thiadiazol-2-yl]-3-p-phenetyl-urea Formula: C20H22N4O2S2 MolecularWeight: 414.54428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)CSCC3=CC=CC(=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)CSCC3=CC=CC(=C3)C

InChI

InChI=1S/C20H22N4O2S2/c1-3-26-17-9-7-16(8-10-17)21-19(25)22-20-24-23-18(28-20)13-27-12-15-6-4-5-14(2)11-15/h4-11H,3,12-13H2,1-2H3,(H2,21,22,24,25)