1,1-dihexyl-3-(2-methylphenyl)thiourea

Systemtic Name: 1,1-dihexyl-3-(2-methylphenyl)thiourea Openeye Name: 1,1-dihexyl-3-(o-tolyl)thiourea CAS Name: 1,1-dihexyl-3-(2-methylphenyl)thiourea IUPAC Name: 1,1-dihexyl-3-(2-methylphenyl)thiourea Traditional Name: 1,1-dihexyl-3-(o-tolyl)thiourea Formula: C20H34N2S MolecularWeight: 334.56236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C(=S)NC1=CC=CC=C1C

Isomeric SMILES

CCCCCCN(CCCCCC)C(=S)NC1=CC=CC=C1C

InChI

InChI=1S/C20H34N2S/c1-4-6-8-12-16-22(17-13-9-7-5-2)20(23)21-19-15-11-10-14-18(19)3/h10-11,14-15H,4-9,12-13,16-17H2,1-3H3,(H,21,23)