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

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-[3-[(1R)-1-phenylethoxy]propyl]thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-[3-[(1R)-1-phenylethoxy]propyl]thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-[3-[(1R)-1-phenylethoxy]propyl]thiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-[3-[(1R)-1-phenylethoxy]propyl]thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-[3-[(1R)-1-phenylethoxy]propyl]thiourea Formula: C18H20ClN3O3S MolecularWeight: 393.8877

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3O3S/c1-13(14-6-3-2-4-7-14)25-11-5-10-20-18(26)21-17-12-15(22(23)24)8-9-16(17)19/h2-4,6-9,12-13H,5,10-11H2,1H3,(H2,20,21,26)/t13-/m1/s1