1-(4-methoxyphenyl)-3-[5-(3-methylbutylsulfanyl)-1,3,4-thiadiazol-2-yl]urea

Systemtic Name: 1-(4-methoxyphenyl)-3-[5-(3-methylbutylsulfanyl)-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-(5-isopentylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(4-methoxyphenyl)urea CAS Name: 1-(4-methoxyphenyl)-3-[5-(3-methylbutylthio)-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-(4-methoxyphenyl)-3-[5-(3-methylbutylsulfanyl)-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-[5-(isoamylthio)-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)urea Formula: C15H20N4O2S2 MolecularWeight: 352.4749

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NN=C(S1)NC(=O)NC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)CCSC1=NN=C(S1)NC(=O)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C15H20N4O2S2/c1-10(2)8-9-22-15-19-18-14(23-15)17-13(20)16-11-4-6-12(21-3)7-5-11/h4-7,10H,8-9H2,1-3H3,(H2,16,17,18,20)