1-(3,5-dimethylphenyl)-3-(3-methylbutyl)thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-(3-methylbutyl)thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-isopentyl-thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-(3-methylbutyl)thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-(3-methylbutyl)thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-isoamyl-thiourea Formula: C14H22N2S MolecularWeight: 250.40288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NCCC(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NCCC(C)C)C

InChI

InChI=1S/C14H22N2S/c1-10(2)5-6-15-14(17)16-13-8-11(3)7-12(4)9-13/h7-10H,5-6H2,1-4H3,(H2,15,16,17)