1-(2-chloranyl-5-nitro-phenyl)-3-[(2R)-2-(dimethylamino)-3-phenyl-propyl]thiourea

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-[(2R)-2-(dimethylamino)-3-phenyl-propyl]thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-[(2R)-2-(dimethylamino)-3-phenyl-propyl]thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-[(2R)-2-(dimethylamino)-3-phenylpropyl]thiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-[(2R)-2-(dimethylamino)-3-phenylpropyl]thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-[(2R)-2-(dimethylamino)-3-phenyl-propyl]thiourea Formula: C18H21ClN4O2S MolecularWeight: 392.90294

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CC1=CC=CC=C1)CNC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CN(C)[C@H](CC1=CC=CC=C1)CNC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H21ClN4O2S/c1-22(2)15(10-13-6-4-3-5-7-13)12-20-18(26)21-17-11-14(23(24)25)8-9-16(17)19/h3-9,11,15H,10,12H2,1-2H3,(H2,20,21,26)/t15-/m1/s1