1-[(4-fluoranyl-3-nitro-phenyl)carbonylamino]-3-[(2R)-1-methoxypropan-2-yl]thiourea

Systemtic Name: 1-[(4-fluoranyl-3-nitro-phenyl)carbonylamino]-3-[(2R)-1-methoxypropan-2-yl]thiourea Openeye Name: 1-[(4-fluoro-3-nitro-benzoyl)amino]-3-[(1R)-2-methoxy-1-methyl-ethyl]thiourea CAS Name: 1-[[(4-fluoro-3-nitrophenyl)-oxomethyl]amino]-3-[(2R)-1-methoxypropan-2-yl]thiourea IUPAC Name: 1-[(4-fluoro-3-nitrobenzoyl)amino]-3-[(2R)-1-methoxypropan-2-yl]thiourea Traditional Name: 1-[(4-fluoro-3-nitro-benzoyl)amino]-3-[(1R)-2-methoxy-1-methyl-ethyl]thiourea Formula: C12H15FN4O4S MolecularWeight: 330.335303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC(=S)NNC(=O)C1=CC(=C(C=C1)F)[N+](=O)[O-]

Isomeric SMILES

C[C@H](COC)NC(=S)NNC(=O)C1=CC(=C(C=C1)F)[N+](=O)[O-]

InChI

InChI=1S/C12H15FN4O4S/c1-7(6-21-2)14-12(22)16-15-11(18)8-3-4-9(13)10(5-8)17(19)20/h3-5,7H,6H2,1-2H3,(H,15,18)(H2,14,16,22)/t7-/m1/s1