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1-[(2,4-dinitrophenyl)amino]-3-[(2S)-2-ethylhexyl]thiourea

1-[(2,4-dinitrophenyl)amino]-3-[(2S)-2-ethylhexyl]thiourea

Systemtic Name:1-[(2,4-dinitrophenyl)amino]-3-[(2S)-2-ethylhexyl]thiourea
Openeye Name:1-(2,4-dinitroanilino)-3-[(2S)-2-ethylhexyl]thiourea
CAS Name:1-(2,4-dinitroanilino)-3-[(2S)-2-ethylhexyl]thiourea
IUPAC Name:1-(2,4-dinitroanilino)-3-[(2S)-2-ethylhexyl]thiourea
Traditional Name:1-(2,4-dinitroanilino)-3-[(2S)-2-ethylhexyl]thiourea
Formula: C15H23N5O4S
MolecularWeight: 369.43922
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

CCCC[C@H](CC)CNC(=S)NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C15H23N5O4S/c1-3-5-6-11(4-2)10-16-15(25)18-17-13-8-7-12(19(21)22)9-14(13)20(23)24/h7-9,11,17H,3-6,10H2,1-2H3,(H2,16,18,25)/t11-/m0/s1


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