1-(5-bromanyl-4-butan-2-yl-3-cyano-thiophen-2-yl)-3-methyl-urea

Systemtic Name: 1-(5-bromanyl-4-butan-2-yl-3-cyano-thiophen-2-yl)-3-methyl-urea Openeye Name: 1-(5-bromo-3-cyano-4-sec-butyl-2-thienyl)-3-methyl-urea CAS Name: 1-(5-bromo-4-butan-2-yl-3-cyano-2-thiophenyl)-3-methylurea IUPAC Name: 1-(5-bromo-4-butan-2-yl-3-cyanothiophen-2-yl)-3-methylurea Traditional Name: 1-(5-bromo-3-cyano-4-sec-butyl-2-thienyl)-3-methyl-urea Formula: C11H14BrN3OS MolecularWeight: 316.21736

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(SC(=C1C#N)NC(=O)NC)Br

Isomeric SMILES

CCC(C)C1=C(SC(=C1C#N)NC(=O)NC)Br

InChI

InChI=1S/C11H14BrN3OS/c1-4-6(2)8-7(5-13)10(17-9(8)12)15-11(16)14-3/h6H,4H2,1-3H3,(H2,14,15,16)