1-[5-(3-cyano-2-methyl-pentan-2-yl)-1,3,4-thiadiazol-2-yl]-3-ethyl-1-methyl-urea

Systemtic Name: 1-[5-(3-cyano-2-methyl-pentan-2-yl)-1,3,4-thiadiazol-2-yl]-3-ethyl-1-methyl-urea Openeye Name: 1-[5-(2-cyano-1,1-dimethyl-butyl)-1,3,4-thiadiazol-2-yl]-3-ethyl-1-methyl-urea CAS Name: 1-[5-(3-cyano-2-methylpentan-2-yl)-1,3,4-thiadiazol-2-yl]-3-ethyl-1-methylurea IUPAC Name: 1-[5-(3-cyano-2-methylpentan-2-yl)-1,3,4-thiadiazol-2-yl]-3-ethyl-1-methylurea Traditional Name: 1-[5-(2-cyano-1,1-dimethyl-butyl)-1,3,4-thiadiazol-2-yl]-3-ethyl-1-methyl-urea Formula: C13H21N5OS MolecularWeight: 295.40374

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#N)C(C)(C)C1=NN=C(S1)N(C)C(=O)NCC

Isomeric SMILES

CCC(C#N)C(C)(C)C1=NN=C(S1)N(C)C(=O)NCC

InChI

InChI=1S/C13H21N5OS/c1-6-9(8-14)13(3,4)10-16-17-12(20-10)18(5)11(19)15-7-2/h9H,6-7H2,1-5H3,(H,15,19)