1-butan-2-yl-3-(2-chloranyl-5-nitro-phenyl)thiourea

Systemtic Name: 1-butan-2-yl-3-(2-chloranyl-5-nitro-phenyl)thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-sec-butyl-thiourea CAS Name: 1-butan-2-yl-3-(2-chloro-5-nitrophenyl)thiourea IUPAC Name: 1-butan-2-yl-3-(2-chloro-5-nitrophenyl)thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-sec-butyl-thiourea Formula: C11H14ClN3O2S MolecularWeight: 287.76576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14ClN3O2S/c1-3-7(2)13-11(18)14-10-6-8(15(16)17)4-5-9(10)12/h4-7H,3H2,1-2H3,(H2,13,14,18)