1-[(5-chloranyl-1-benzofuran-2-yl)carbonylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea

Systemtic Name: 1-[(5-chloranyl-1-benzofuran-2-yl)carbonylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea Openeye Name: 1-[(5-chlorobenzofuran-2-carbonyl)amino]-3-(2-ethyl-6-methyl-phenyl)thiourea CAS Name: 1-[[(5-chloro-2-benzofuranyl)-oxomethyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-[(5-chloro-1-benzofuran-2-carbonyl)amino]-3-(2-ethyl-6-methylphenyl)thiourea Traditional Name: 1-[(5-chlorobenzofuran-2-carbonyl)amino]-3-(2-ethyl-6-methyl-phenyl)thiourea Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=CC3=C(O2)C=CC(=C3)Cl)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=CC3=C(O2)C=CC(=C3)Cl)C

InChI

InChI=1S/C19H18ClN3O2S/c1-3-12-6-4-5-11(2)17(12)21-19(26)23-22-18(24)16-10-13-9-14(20)7-8-15(13)25-16/h4-10H,3H2,1-2H3,(H,22,24)(H2,21,23,26)