4-[3-cyclohexyl-2,5-bis(3-nitrophenyl)-4-(phenylcarbonyl)imidazolidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[3-cyclohexyl-2,5-bis(3-nitrophenyl)-4-(phenylcarbonyl)imidazolidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-benzoyl-3-cyclohexyl-2,5-bis(3-nitrophenyl)imidazolidin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-benzoyl-3-cyclohexyl-2,5-bis(3-nitrophenyl)-1-imidazolidinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-benzoyl-3-cyclohexyl-2,5-bis(3-nitrophenyl)imidazolidin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-benzoyl-3-cyclohexyl-2,5-bis(3-nitrophenyl)imidazolidin-1-yl]sulfonylbenzonitrile Formula: C35H31N5O7S MolecularWeight: 665.71494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(C(N(C2C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=C(C=C4)C#N)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)N2C(C(N(C2C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=C(C=C4)C#N)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)C6=CC=CC=C6

InChI

InChI=1S/C35H31N5O7S/c36-23-24-17-19-31(20-18-24)48(46,47)38-32(26-11-7-15-29(21-26)39(42)43)33(34(41)25-9-3-1-4-10-25)37(28-13-5-2-6-14-28)35(38)27-12-8-16-30(22-27)40(44)45/h1,3-4,7-12,15-22,28,32-33,35H,2,5-6,13-14H2