2-(1-cyclopropylimidazol-2-yl)sulfanyl-5-nitro-benzenecarbonitrile

Systemtic Name: 2-(1-cyclopropylimidazol-2-yl)sulfanyl-5-nitro-benzenecarbonitrile Openeye Name: 2-(1-cyclopropylimidazol-2-yl)sulfanyl-5-nitro-benzonitrile CAS Name: 2-[(1-cyclopropyl-2-imidazolyl)thio]-5-nitrobenzonitrile IUPAC Name: 2-(1-cyclopropylimidazol-2-yl)sulfanyl-5-nitrobenzonitrile Traditional Name: 2-[(1-cyclopropylimidazol-2-yl)thio]-5-nitro-benzonitrile Formula: C13H10N4O2S MolecularWeight: 286.3091

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=CN=C2SC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1CC1N2C=CN=C2SC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C13H10N4O2S/c14-8-9-7-11(17(18)19)3-4-12(9)20-13-15-5-6-16(13)10-1-2-10/h3-7,10H,1-2H2