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N-[(Z)-[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]methylideneamino]-2,4-dinitro-aniline

N-[(Z)-[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]methylideneamino]-2,4-dinitro-aniline

Systemtic Name:N-[(Z)-[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]methylideneamino]-2,4-dinitro-aniline
Openeye Name:2,4-dinitro-N-[(Z)-[3-nitro-4-(p-tolylsulfanyl)phenyl]methyleneamino]aniline
CAS Name:N-[(Z)-[4-[(4-methylphenyl)thio]-3-nitrophenyl]methylideneamino]-2,4-dinitroaniline
IUPAC Name:N-[(Z)-[4-(4-methylphenyl)sulfanyl-3-nitrophenyl]methylideneamino]-2,4-dinitroaniline
Traditional Name:(2,4-dinitrophenyl)-[(Z)-[3-nitro-4-(p-tolylthio)benzylidene]amino]amine
Formula: C20H15N5O6S
MolecularWeight: 453.428
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C=NNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)/C=N\NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C20H15N5O6S/c1-13-2-6-16(7-3-13)32-20-9-4-14(10-19(20)25(30)31)12-21-22-17-8-5-15(23(26)27)11-18(17)24(28)29/h2-12,22H,1H3/b21-12-


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