3-[(2R)-2-ethylhexyl]-1-methyl-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea

Systemtic Name: 3-[(2R)-2-ethylhexyl]-1-methyl-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea Openeye Name: 3-[(2R)-2-ethylhexyl]-1-methyl-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea CAS Name: 3-[(2R)-2-ethylhexyl]-1-methyl-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea IUPAC Name: 3-[(2R)-2-ethylhexyl]-1-methyl-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea Traditional Name: 3-[(2R)-2-ethylhexyl]-1-methyl-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea Formula: C18H29N3O2S MolecularWeight: 351.50676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)N(C)C(C)C1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CCCC[C@@H](CC)CNC(=S)N(C)[C@H](C)C1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C18H29N3O2S/c1-5-7-9-15(6-2)13-19-18(24)20(4)14(3)16-10-8-11-17(12-16)21(22)23/h8,10-12,14-15H,5-7,9,13H2,1-4H3,(H,19,24)/t14-,15-/m1/s1