1-cyclopentyl-3-[[(E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoyl]amino]thiourea

Systemtic Name: 1-cyclopentyl-3-[[(E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoyl]amino]thiourea Openeye Name: 1-cyclopentyl-3-[[(E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoyl]amino]thiourea CAS Name: 1-cyclopentyl-3-[[(E)-1-oxo-3-(2,4,5-trimethoxyphenyl)prop-2-enyl]amino]thiourea IUPAC Name: 1-cyclopentyl-3-[[(E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoyl]amino]thiourea Traditional Name: 1-[[(E)-3-asarylacryloyl]amino]-3-cyclopentyl-thiourea Formula: C18H25N3O4S MolecularWeight: 379.4738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=CC(=O)NNC(=S)NC2CCCC2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1/C=C/C(=O)NNC(=S)NC2CCCC2)OC)OC

InChI

InChI=1S/C18H25N3O4S/c1-23-14-11-16(25-3)15(24-2)10-12(14)8-9-17(22)20-21-18(26)19-13-6-4-5-7-13/h8-11,13H,4-7H2,1-3H3,(H,20,22)(H2,19,21,26)/b9-8+