3-butyl-1-[5-[(3-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-methyl-urea

Systemtic Name: 3-butyl-1-[5-[(3-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-methyl-urea Openeye Name: 3-butyl-1-[5-[(3-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-methyl-urea CAS Name: 3-butyl-1-[5-[(3-chlorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-1-methylurea IUPAC Name: 3-butyl-1-[5-[(3-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-methylurea Traditional Name: 3-butyl-1-[5-[(3-chlorobenzyl)thio]-1,3,4-thiadiazol-2-yl]-1-methyl-urea Formula: C15H19ClN4OS2 MolecularWeight: 370.92056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(C)C1=NN=C(S1)SCC2=CC(=CC=C2)Cl

Isomeric SMILES

CCCCNC(=O)N(C)C1=NN=C(S1)SCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C15H19ClN4OS2/c1-3-4-8-17-13(21)20(2)14-18-19-15(23-14)22-10-11-6-5-7-12(16)9-11/h5-7,9H,3-4,8,10H2,1-2H3,(H,17,21)