1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[(E)-3-phenylprop-2-enoyl]amino]thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[(E)-3-phenylprop-2-enoyl]amino]thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[(E)-3-phenylprop-2-enoyl]amino]thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[(E)-3-phenylprop-2-enoyl]amino]thiourea Traditional Name: 1-homoveratryl-3-[[(E)-3-phenylacryloyl]amino]thiourea Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)C=CC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)/C=C/C2=CC=CC=C2)OC

InChI

InChI=1S/C20H23N3O3S/c1-25-17-10-8-16(14-18(17)26-2)12-13-21-20(27)23-22-19(24)11-9-15-6-4-3-5-7-15/h3-11,14H,12-13H2,1-2H3,(H,22,24)(H2,21,23,27)/b11-9+