1-[5-(1-cyanobutan-2-yl)-1,3,4-thiadiazol-2-yl]-1-methyl-3-propyl-urea

Systemtic Name: 1-[5-(1-cyanobutan-2-yl)-1,3,4-thiadiazol-2-yl]-1-methyl-3-propyl-urea Openeye Name: 1-[5-[1-(cyanomethyl)propyl]-1,3,4-thiadiazol-2-yl]-1-methyl-3-propyl-urea CAS Name: 1-[5-(1-cyanobutan-2-yl)-1,3,4-thiadiazol-2-yl]-1-methyl-3-propylurea IUPAC Name: 1-[5-(1-cyanobutan-2-yl)-1,3,4-thiadiazol-2-yl]-1-methyl-3-propylurea Traditional Name: 1-[5-[1-(cyanomethyl)propyl]-1,3,4-thiadiazol-2-yl]-1-methyl-3-propyl-urea Formula: C12H19N5OS MolecularWeight: 281.37716

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N(C)C1=NN=C(S1)C(CC)CC#N

Isomeric SMILES

CCCNC(=O)N(C)C1=NN=C(S1)C(CC)CC#N

InChI

InChI=1S/C12H19N5OS/c1-4-8-14-11(18)17(3)12-16-15-10(19-12)9(5-2)6-7-13/h9H,4-6,8H2,1-3H3,(H,14,18)