1-(3-butoxypropyl)-3-(2-chloranyl-5-nitro-phenyl)thiourea

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20ClN3O3S/c1-2-3-8-21-9-4-7-16-14(22)17-13-10-11(18(19)20)5-6-12(13)15/h5-6,10H,2-4,7-9H2,1H3,(H2,16,17,22)