1-[2-(6-chloranylnaphthalen-2-yl)sulfonyl-4-[1-(triphenylmethyl)imidazol-4-yl]piperidin-1-yl]propan-1-one

Systemtic Name: 1-[2-(6-chloranylnaphthalen-2-yl)sulfonyl-4-[1-(triphenylmethyl)imidazol-4-yl]piperidin-1-yl]propan-1-one Openeye Name: 1-[2-[(6-chloro-2-naphthyl)sulfonyl]-4-(1-tritylimidazol-4-yl)-1-piperidyl]propan-1-one CAS Name: 1-[2-[(6-chloro-2-naphthalenyl)sulfonyl]-4-[1-(triphenylmethyl)-4-imidazolyl]-1-piperidinyl]-1-propanone IUPAC Name: 1-[2-(6-chloronaphthalen-2-yl)sulfonyl-4-(1-tritylimidazol-4-yl)piperidin-1-yl]propan-1-one Traditional Name: 1-[2-[(6-chloro-2-naphthyl)sulfonyl]-4-(1-tritylimidazol-4-yl)piperidino]propan-1-one Formula: C40H36ClN3O3S MolecularWeight: 674.25014

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC(CC1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)C4=CN(C=N4)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

CCC(=O)N1CCC(CC1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)C4=CN(C=N4)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C40H36ClN3O3S/c1-2-38(45)44-23-22-31(26-39(44)48(46,47)36-21-19-29-24-35(41)20-18-30(29)25-36)37-27-43(28-42-37)40(32-12-6-3-7-13-32,33-14-8-4-9-15-33)34-16-10-5-11-17-34/h3-21,24-25,27-28,31,39H,2,22-23,26H2,1H3