1-(3-methylphenyl)-3-pentan-3-yl-thiourea

Systemtic Name: 1-(3-methylphenyl)-3-pentan-3-yl-thiourea Openeye Name: 1-(1-ethylpropyl)-3-(m-tolyl)thiourea CAS Name: 1-(3-methylphenyl)-3-pentan-3-ylthiourea IUPAC Name: 1-(3-methylphenyl)-3-pentan-3-ylthiourea Traditional Name: 1-(1-ethylpropyl)-3-(m-tolyl)thiourea Formula: C13H20N2S MolecularWeight: 236.3763

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2S/c1-4-11(5-2)14-13(16)15-12-8-6-7-10(3)9-12/h6-9,11H,4-5H2,1-3H3,(H2,14,15,16)