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

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-[3-(diethylamino)propyl]thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-[3-(diethylamino)propyl]thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-[3-(diethylamino)propyl]thiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-[3-(diethylamino)propyl]thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-[3-(diethylamino)propyl]thiourea Formula: C14H21ClN4O2S MolecularWeight: 344.86014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21ClN4O2S/c1-3-18(4-2)9-5-8-16-14(22)17-13-10-11(19(20)21)6-7-12(13)15/h6-7,10H,3-5,8-9H2,1-2H3,(H2,16,17,22)