1-(4-cyanophenyl)-3-(2-methylbutan-2-yl)thiourea

Systemtic Name: 1-(4-cyanophenyl)-3-(2-methylbutan-2-yl)thiourea Openeye Name: 1-(4-cyanophenyl)-3-(1,1-dimethylpropyl)thiourea CAS Name: 1-(4-cyanophenyl)-3-(2-methylbutan-2-yl)thiourea IUPAC Name: 1-(4-cyanophenyl)-3-(2-methylbutan-2-yl)thiourea Traditional Name: 1-tert-amyl-3-(4-cyanophenyl)thiourea Formula: C13H17N3S MolecularWeight: 247.35918

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=S)NC1=CC=C(C=C1)C#N

Isomeric SMILES

CCC(C)(C)NC(=S)NC1=CC=C(C=C1)C#N

InChI

InChI=1S/C13H17N3S/c1-4-13(2,3)16-12(17)15-11-7-5-10(9-14)6-8-11/h5-8H,4H2,1-3H3,(H2,15,16,17)