1-(furan-2-ylmethyl)-3-[2-[(2,3,4,5,6-pentamethylphenyl)methylsulfanyl]ethanoylamino]thiourea

Systemtic Name: 1-(furan-2-ylmethyl)-3-[2-[(2,3,4,5,6-pentamethylphenyl)methylsulfanyl]ethanoylamino]thiourea Openeye Name: 1-(2-furylmethyl)-3-[[2-[(2,3,4,5,6-pentamethylphenyl)methylsulfanyl]acetyl]amino]thiourea CAS Name: 1-(2-furanylmethyl)-3-[[1-oxo-2-[(2,3,4,5,6-pentamethylphenyl)methylthio]ethyl]amino]thiourea IUPAC Name: 1-(furan-2-ylmethyl)-3-[[2-[(2,3,4,5,6-pentamethylphenyl)methylsulfanyl]acetyl]amino]thiourea Traditional Name: 1-(2-furfuryl)-3-[[2-[(2,3,4,5,6-pentamethylbenzyl)thio]acetyl]amino]thiourea Formula: C20H27N3O2S2 MolecularWeight: 405.57728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)CSCC(=O)NNC(=S)NCC2=CC=CO2)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)CSCC(=O)NNC(=S)NCC2=CC=CO2)C)C

InChI

InChI=1S/C20H27N3O2S2/c1-12-13(2)15(4)18(16(5)14(12)3)10-27-11-19(24)22-23-20(26)21-9-17-7-6-8-25-17/h6-8H,9-11H2,1-5H3,(H,22,24)(H2,21,23,26)