1-[(3,4-dimethoxyphenyl)methyl]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(3,4-dimethoxyphenyl)methyl]thiourea CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-prop-2-enylthiourea IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-veratryl-thiourea Formula: C13H18N2O2S MolecularWeight: 266.35922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=S)NCC=C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=S)NCC=C)OC

InChI

InChI=1S/C13H18N2O2S/c1-4-7-14-13(18)15-9-10-5-6-11(16-2)12(8-10)17-3/h4-6,8H,1,7,9H2,2-3H3,(H2,14,15,18)