1-[(2S)-2-ethylhexyl]-3-[(2-methylphenyl)carbonylamino]thiourea

Systemtic Name: 1-[(2S)-2-ethylhexyl]-3-[(2-methylphenyl)carbonylamino]thiourea Openeye Name: 1-[(2S)-2-ethylhexyl]-3-[(2-methylbenzoyl)amino]thiourea CAS Name: 1-[(2S)-2-ethylhexyl]-3-[[(2-methylphenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-[(2S)-2-ethylhexyl]-3-[(2-methylbenzoyl)amino]thiourea Traditional Name: 1-[(2S)-2-ethylhexyl]-3-(o-toluoylamino)thiourea Formula: C17H27N3OS MolecularWeight: 321.48078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)NNC(=O)C1=CC=CC=C1C

Isomeric SMILES

CCCC[C@H](CC)CNC(=S)NNC(=O)C1=CC=CC=C1C

InChI

InChI=1S/C17H27N3OS/c1-4-6-10-14(5-2)12-18-17(22)20-19-16(21)15-11-8-7-9-13(15)3/h7-9,11,14H,4-6,10,12H2,1-3H3,(H,19,21)(H2,18,20,22)/t14-/m0/s1