1-(6-cyanopyridin-3-yl)-3-(3,3-dimethylbutan-2-yl)thiourea

Systemtic Name: 1-(6-cyanopyridin-3-yl)-3-(3,3-dimethylbutan-2-yl)thiourea Openeye Name: 1-(6-cyano-3-pyridyl)-3-(1,2,2-trimethylpropyl)thiourea CAS Name: 1-(6-cyano-3-pyridinyl)-3-(3,3-dimethylbutan-2-yl)thiourea IUPAC Name: 1-(6-cyanopyridin-3-yl)-3-(3,3-dimethylbutan-2-yl)thiourea Traditional Name: 1-(6-cyano-3-pyridyl)-3-(1,2,2-trimethylpropyl)thiourea Formula: C13H18N4S MolecularWeight: 262.37382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N4S/c1-9(13(2,3)4)16-12(18)17-11-6-5-10(7-14)15-8-11/h5-6,8-9H,1-4H3,(H2,16,17,18)