4-[(E)-[2-butylimino-4-(4-cyclohexylphenyl)-1,3-thiazol-3-yl]iminomethyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-[2-butylimino-4-(4-cyclohexylphenyl)-1,3-thiazol-3-yl]iminomethyl]benzenecarbonitrile Openeye Name: 4-[(E)-[2-butylimino-4-(4-cyclohexylphenyl)thiazol-3-yl]iminomethyl]benzonitrile CAS Name: 4-[(E)-[2-butylimino-4-(4-cyclohexylphenyl)-3-thiazolyl]iminomethyl]benzonitrile IUPAC Name: 4-[(E)-[2-butylimino-4-(4-cyclohexylphenyl)-1,3-thiazol-3-yl]iminomethyl]benzonitrile Traditional Name: 4-[(E)-[2-butylimino-4-(4-cyclohexylphenyl)-4-thiazolin-3-yl]iminomethyl]benzonitrile Formula: C27H30N4S MolecularWeight: 442.6189

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C1N(C(=CS1)C2=CC=C(C=C2)C3CCCCC3)N=CC4=CC=C(C=C4)C#N

Isomeric SMILES

CCCCN=C1N(C(=CS1)C2=CC=C(C=C2)C3CCCCC3)/N=C/C4=CC=C(C=C4)C#N

InChI

InChI=1S/C27H30N4S/c1-2-3-17-29-27-31(30-19-22-11-9-21(18-28)10-12-22)26(20-32-27)25-15-13-24(14-16-25)23-7-5-4-6-8-23/h9-16,19-20,23H,2-8,17H2,1H3/b29-27?,30-19+