1-[[2-(dimethylamino)-5-nitro-phenyl]carbonylamino]-3-[(2R)-1-methoxypropan-2-yl]thiourea

Systemtic Name: 1-[[2-(dimethylamino)-5-nitro-phenyl]carbonylamino]-3-[(2R)-1-methoxypropan-2-yl]thiourea Openeye Name: 1-[[2-(dimethylamino)-5-nitro-benzoyl]amino]-3-[(1R)-2-methoxy-1-methyl-ethyl]thiourea CAS Name: 1-[[[2-(dimethylamino)-5-nitrophenyl]-oxomethyl]amino]-3-[(2R)-1-methoxypropan-2-yl]thiourea IUPAC Name: 1-[[2-(dimethylamino)-5-nitrobenzoyl]amino]-3-[(2R)-1-methoxypropan-2-yl]thiourea Traditional Name: 1-[[2-(dimethylamino)-5-nitro-benzoyl]amino]-3-[(1R)-2-methoxy-1-methyl-ethyl]thiourea Formula: C14H21N5O4S MolecularWeight: 355.41264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N5O4S/c1-9(8-23-4)15-14(24)17-16-13(20)11-7-10(19(21)22)5-6-12(11)18(2)3/h5-7,9H,8H2,1-4H3,(H,16,20)(H2,15,17,24)/t9-/m1/s1