4-[4-[4-(1,3-benzodioxol-5-yl)-5-pyridin-2-yl-1H-imidazol-2-yl]piperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[4-(1,3-benzodioxol-5-yl)-5-pyridin-2-yl-1H-imidazol-2-yl]piperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[[4-[4-(1,3-benzodioxol-5-yl)-5-(2-pyridyl)-1H-imidazol-2-yl]-1-piperidyl]sulfonyl]benzonitrile CAS Name: 4-[[4-[4-(1,3-benzodioxol-5-yl)-5-(2-pyridinyl)-1H-imidazol-2-yl]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[4-(1,3-benzodioxol-5-yl)-5-pyridin-2-yl-1H-imidazol-2-yl]piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[4-(1,3-benzodioxol-5-yl)-5-(2-pyridyl)-1H-imidazol-2-yl]piperidino]sulfonylbenzonitrile Formula: C27H23N5O4S MolecularWeight: 513.56762

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=C(N2)C3=CC=CC=N3)C4=CC5=C(C=C4)OCO5)S(=O)(=O)C6=CC=C(C=C6)C#N

Isomeric SMILES

C1CN(CCC1C2=NC(=C(N2)C3=CC=CC=N3)C4=CC5=C(C=C4)OCO5)S(=O)(=O)C6=CC=C(C=C6)C#N

InChI

InChI=1S/C27H23N5O4S/c28-16-18-4-7-21(8-5-18)37(33,34)32-13-10-19(11-14-32)27-30-25(26(31-27)22-3-1-2-12-29-22)20-6-9-23-24(15-20)36-17-35-23/h1-9,12,15,19H,10-11,13-14,17H2,(H,30,31)