1-(4-butan-2-yl-3-cyano-thiophen-2-yl)-3-ethyl-urea

Systemtic Name: 1-(4-butan-2-yl-3-cyano-thiophen-2-yl)-3-ethyl-urea Openeye Name: 1-(3-cyano-4-sec-butyl-2-thienyl)-3-ethyl-urea CAS Name: 1-(4-butan-2-yl-3-cyano-2-thiophenyl)-3-ethylurea IUPAC Name: 1-(4-butan-2-yl-3-cyanothiophen-2-yl)-3-ethylurea Traditional Name: 1-(3-cyano-4-sec-butyl-2-thienyl)-3-ethyl-urea Formula: C12H17N3OS MolecularWeight: 251.34788

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CSC(=C1C#N)NC(=O)NCC

Isomeric SMILES

CCC(C)C1=CSC(=C1C#N)NC(=O)NCC

InChI

InChI=1S/C12H17N3OS/c1-4-8(3)10-7-17-11(9(10)6-13)15-12(16)14-5-2/h7-8H,4-5H2,1-3H3,(H2,14,15,16)