(4-piperidin-1-ylsulfonylphenyl)-[2-(pyridin-3-ylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]methanone

Systemtic Name: (4-piperidin-1-ylsulfonylphenyl)-[2-(pyridin-3-ylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]methanone Openeye Name: [4-(1-piperidylsulfonyl)phenyl]-[2-(3-pyridylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]methanone CAS Name: [4-(1-piperidinylsulfonyl)phenyl]-[2-(3-pyridinylmethylthio)-4,5-dihydroimidazol-1-yl]methanone IUPAC Name: (4-piperidin-1-ylsulfonylphenyl)-[2-(pyridin-3-ylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]methanone Traditional Name: (4-piperidinosulfonylphenyl)-[2-(3-pyridylmethylthio)-2-imidazolin-1-yl]methanone Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN=C3SCC4=CN=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN=C3SCC4=CN=CC=C4

InChI

InChI=1S/C21H24N4O3S2/c26-20(25-14-11-23-21(25)29-16-17-5-4-10-22-15-17)18-6-8-19(9-7-18)30(27,28)24-12-2-1-3-13-24/h4-10,15H,1-3,11-14,16H2