4-[2,4-bis(chloranyl)-5-methyl-phenyl]sulfanyl-3,5-dinitro-benzenecarbonitrile

Systemtic Name: 4-[2,4-bis(chloranyl)-5-methyl-phenyl]sulfanyl-3,5-dinitro-benzenecarbonitrile Openeye Name: 4-(2,4-dichloro-5-methyl-phenyl)sulfanyl-3,5-dinitro-benzonitrile CAS Name: 4-[(2,4-dichloro-5-methylphenyl)thio]-3,5-dinitrobenzonitrile IUPAC Name: 4-(2,4-dichloro-5-methylphenyl)sulfanyl-3,5-dinitrobenzonitrile Traditional Name: 4-[(2,4-dichloro-5-methyl-phenyl)thio]-3,5-dinitro-benzonitrile Formula: C14H7Cl2N3O4S MolecularWeight: 384.19408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)Cl)SC2=C(C=C(C=C2[N+](=O)[O-])C#N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1Cl)Cl)SC2=C(C=C(C=C2[N+](=O)[O-])C#N)[N+](=O)[O-]

InChI

InChI=1S/C14H7Cl2N3O4S/c1-7-2-13(10(16)5-9(7)15)24-14-11(18(20)21)3-8(6-17)4-12(14)19(22)23/h2-5H,1H3