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

Systemtic Name: 3-(2-ethylphenyl)-1,1-dihexyl-thiourea Openeye Name: 3-(2-ethylphenyl)-1,1-dihexyl-thiourea CAS Name: 3-(2-ethylphenyl)-1,1-dihexylthiourea IUPAC Name: 3-(2-ethylphenyl)-1,1-dihexylthiourea Traditional Name: 3-(2-ethylphenyl)-1,1-dihexyl-thiourea Formula: C21H36N2S MolecularWeight: 348.58894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C(=S)NC1=CC=CC=C1CC

Isomeric SMILES

CCCCCCN(CCCCCC)C(=S)NC1=CC=CC=C1CC

InChI

InChI=1S/C21H36N2S/c1-4-7-9-13-17-23(18-14-10-8-5-2)21(24)22-20-16-12-11-15-19(20)6-3/h11-12,15-16H,4-10,13-14,17-18H2,1-3H3,(H,22,24)