1-[[3-(ethoxymethyl)-1-benzofuran-2-yl]carbonylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea

Systemtic Name: 1-[[3-(ethoxymethyl)-1-benzofuran-2-yl]carbonylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea Openeye Name: 1-[[3-(ethoxymethyl)benzofuran-2-carbonyl]amino]-3-(2-ethyl-6-methyl-phenyl)thiourea CAS Name: 1-[[[3-(ethoxymethyl)-2-benzofuranyl]-oxomethyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-[[3-(ethoxymethyl)-1-benzofuran-2-carbonyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea Traditional Name: 1-[[3-(ethoxymethyl)benzofuran-2-carbonyl]amino]-3-(2-ethyl-6-methyl-phenyl)thiourea Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=C(C3=CC=CC=C3O2)COCC)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=C(C3=CC=CC=C3O2)COCC)C

InChI

InChI=1S/C22H25N3O3S/c1-4-15-10-8-9-14(3)19(15)23-22(29)25-24-21(26)20-17(13-27-5-2)16-11-6-7-12-18(16)28-20/h6-12H,4-5,13H2,1-3H3,(H,24,26)(H2,23,25,29)