1-[2-(4-ethoxyphenyl)sulfanylethanoylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea

Systemtic Name: 1-[2-(4-ethoxyphenyl)sulfanylethanoylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea Openeye Name: 1-[[2-(4-ethoxyphenyl)sulfanylacetyl]amino]-3-(2-ethyl-6-methyl-phenyl)thiourea CAS Name: 1-[[2-[(4-ethoxyphenyl)thio]-1-oxoethyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-[[2-(4-ethoxyphenyl)sulfanylacetyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[2-(p-phenetylthio)acetyl]amino]thiourea Formula: C20H25N3O2S2 MolecularWeight: 403.5614

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)CSC2=CC=C(C=C2)OCC)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)CSC2=CC=C(C=C2)OCC)C

InChI

InChI=1S/C20H25N3O2S2/c1-4-15-8-6-7-14(3)19(15)21-20(26)23-22-18(24)13-27-17-11-9-16(10-12-17)25-5-2/h6-12H,4-5,13H2,1-3H3,(H,22,24)(H2,21,23,26)