1-[(2S)-2-ethylhexyl]-3-[(3-methyl-1-benzofuran-2-yl)carbonylamino]thiourea

Systemtic Name: 1-[(2S)-2-ethylhexyl]-3-[(3-methyl-1-benzofuran-2-yl)carbonylamino]thiourea Openeye Name: 1-[(2S)-2-ethylhexyl]-3-[(3-methylbenzofuran-2-carbonyl)amino]thiourea CAS Name: 1-[(2S)-2-ethylhexyl]-3-[[(3-methyl-2-benzofuranyl)-oxomethyl]amino]thiourea IUPAC Name: 1-[(2S)-2-ethylhexyl]-3-[(3-methyl-1-benzofuran-2-carbonyl)amino]thiourea Traditional Name: 1-[(2S)-2-ethylhexyl]-3-[(3-methylbenzofuran-2-carbonyl)amino]thiourea Formula: C19H27N3O2S MolecularWeight: 361.50158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)NNC(=O)C1=C(C2=CC=CC=C2O1)C

Isomeric SMILES

CCCC[C@H](CC)CNC(=S)NNC(=O)C1=C(C2=CC=CC=C2O1)C

InChI

InChI=1S/C19H27N3O2S/c1-4-6-9-14(5-2)12-20-19(25)22-21-18(23)17-13(3)15-10-7-8-11-16(15)24-17/h7-8,10-11,14H,4-6,9,12H2,1-3H3,(H,21,23)(H2,20,22,25)/t14-/m0/s1