4-[[2-cyclohexylimino-4-(3-nitrophenyl)-1,3-thiazol-3-yl]iminomethyl]benzenecarbonitrile

Systemtic Name: 4-[[2-cyclohexylimino-4-(3-nitrophenyl)-1,3-thiazol-3-yl]iminomethyl]benzenecarbonitrile Openeye Name: 4-[[2-cyclohexylimino-4-(3-nitrophenyl)thiazol-3-yl]iminomethyl]benzonitrile CAS Name: 4-[[2-cyclohexylimino-4-(3-nitrophenyl)-3-thiazolyl]iminomethyl]benzonitrile IUPAC Name: 4-[[2-cyclohexylimino-4-(3-nitrophenyl)-1,3-thiazol-3-yl]iminomethyl]benzonitrile Traditional Name: 4-[[2-cyclohexylimino-4-(3-nitrophenyl)-4-thiazolin-3-yl]iminomethyl]benzonitrile Formula: C23H21N5O2S MolecularWeight: 431.51014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N=C2N(C(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])N=CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CCC(CC1)N=C2N(C(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])N=CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H21N5O2S/c24-14-17-9-11-18(12-10-17)15-25-27-22(19-5-4-8-21(13-19)28(29)30)16-31-23(27)26-20-6-2-1-3-7-20/h4-5,8-13,15-16,20H,1-3,6-7H2