1-[2-(3,4-dimethoxyphenyl)ethyl]-3-undecyl-thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-undecyl-thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-undecyl-thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-undecylthiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-undecylthiourea Traditional Name: 1-homoveratryl-3-undecyl-thiourea Formula: C22H38N2O2S MolecularWeight: 394.61432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCNC(=S)NCCC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CCCCCCCCCCCNC(=S)NCCC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C22H38N2O2S/c1-4-5-6-7-8-9-10-11-12-16-23-22(27)24-17-15-19-13-14-20(25-2)21(18-19)26-3/h13-14,18H,4-12,15-17H2,1-3H3,(H2,23,24,27)