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

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-[3-(2-methylpropoxy)propyl]thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-(3-isobutoxypropyl)thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-[3-(2-methylpropoxy)propyl]thiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-[3-(2-methylpropoxy)propyl]thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-(3-isobutoxypropyl)thiourea Formula: C14H20ClN3O3S MolecularWeight: 345.8449

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCCCNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)COCCCNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H20ClN3O3S/c1-10(2)9-21-7-3-6-16-14(22)17-13-8-11(18(19)20)4-5-12(13)15/h4-5,8,10H,3,6-7,9H2,1-2H3,(H2,16,17,22)