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

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-(2-diethylaminoethyl)thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-(2-diethylaminoethyl)thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-(2-diethylaminoethyl)thiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-(2-diethylaminoethyl)thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-(2-diethylaminoethyl)thiourea Formula: C13H19ClN4O2S MolecularWeight: 330.83356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19ClN4O2S/c1-3-17(4-2)8-7-15-13(21)16-12-9-10(18(19)20)5-6-11(12)14/h5-6,9H,3-4,7-8H2,1-2H3,(H2,15,16,21)