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

Systemtic Name: 1,3-bis[2-(3,4-dimethoxyphenyl)ethyl]thiourea Openeye Name: 1,3-bis[2-(3,4-dimethoxyphenyl)ethyl]thiourea CAS Name: 1,3-bis[2-(3,4-dimethoxyphenyl)ethyl]thiourea IUPAC Name: 1,3-bis[2-(3,4-dimethoxyphenyl)ethyl]thiourea Traditional Name: 1,3-dihomoveratrylthiourea Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NCCC2=CC(=C(C=C2)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NCCC2=CC(=C(C=C2)OC)OC)OC

InChI

InChI=1S/C21H28N2O4S/c1-24-17-7-5-15(13-19(17)26-3)9-11-22-21(28)23-12-10-16-6-8-18(25-2)20(14-16)27-4/h5-8,13-14H,9-12H2,1-4H3,(H2,22,23,28)