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

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]amino]thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]amino]thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[(E)-3-(2-methoxyphenyl)-1-oxoprop-2-enyl]amino]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]amino]thiourea Traditional Name: 1-homoveratryl-3-[[(E)-3-(2-methoxyphenyl)acryloyl]amino]thiourea Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)C=CC2=CC=CC=C2OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)/C=C/C2=CC=CC=C2OC)OC

InChI

InChI=1S/C21H25N3O4S/c1-26-17-7-5-4-6-16(17)9-11-20(25)23-24-21(29)22-13-12-15-8-10-18(27-2)19(14-15)28-3/h4-11,14H,12-13H2,1-3H3,(H,23,25)(H2,22,24,29)/b11-9+