1-(2-methyl-4-oxidanylidene-pentan-2-yl)-3-phenyl-thiourea

Systemtic Name: 1-(2-methyl-4-oxidanylidene-pentan-2-yl)-3-phenyl-thiourea Openeye Name: 1-(1,1-dimethyl-3-oxo-butyl)-3-phenyl-thiourea CAS Name: 1-(2-methyl-4-oxopentan-2-yl)-3-phenylthiourea IUPAC Name: 1-(2-methyl-4-oxopentan-2-yl)-3-phenylthiourea Traditional Name: 1-(3-keto-1,1-dimethyl-butyl)-3-phenyl-thiourea Formula: C13H18N2OS MolecularWeight: 250.35982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C)(C)NC(=S)NC1=CC=CC=C1

Isomeric SMILES

CC(=O)CC(C)(C)NC(=S)NC1=CC=CC=C1

InChI

InChI=1S/C13H18N2OS/c1-10(16)9-13(2,3)15-12(17)14-11-7-5-4-6-8-11/h4-8H,9H2,1-3H3,(H2,14,15,17)