N-[2-(3,4-dichlorophenyl)-4-[4-(2-methylsulfinylphenyl)-2-piperidin-1-yl-piperidin-1-yl]butyl]-N-methyl-3-methylsulfonyl-naphthalene-1-carboxamide

Systemtic Name: N-[2-(3,4-dichlorophenyl)-4-[4-(2-methylsulfinylphenyl)-2-piperidin-1-yl-piperidin-1-yl]butyl]-N-methyl-3-methylsulfonyl-naphthalene-1-carboxamide Openeye Name: N-[2-(3,4-dichlorophenyl)-4-[4-(2-methylsulfinylphenyl)-2-(1-piperidyl)-1-piperidyl]butyl]-N-methyl-3-methylsulfonyl-naphthalene-1-carboxamide CAS Name: N-[2-(3,4-dichlorophenyl)-4-[4-(2-methylsulfinylphenyl)-2-(1-piperidinyl)-1-piperidinyl]butyl]-N-methyl-3-methylsulfonyl-1-naphthalenecarboxamide IUPAC Name: N-[2-(3,4-dichlorophenyl)-4-[4-(2-methylsulfinylphenyl)-2-piperidin-1-ylpiperidin-1-yl]butyl]-N-methyl-3-methylsulfonylnaphthalene-1-carboxamide Traditional Name: N-[2-(3,4-dichlorophenyl)-4-[4-(2-methylsulfinylphenyl)-2-piperidino-piperidino]butyl]-3-mesyl-N-methyl-1-naphthamide Formula: C40H47Cl2N3O4S2 MolecularWeight: 768.85488

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(CCN1CCC(CC1N2CCCCC2)C3=CC=CC=C3S(=O)C)C4=CC(=C(C=C4)Cl)Cl)C(=O)C5=CC(=CC6=CC=CC=C65)S(=O)(=O)C

Isomeric SMILES

CN(CC(CCN1CCC(CC1N2CCCCC2)C3=CC=CC=C3S(=O)C)C4=CC(=C(C=C4)Cl)Cl)C(=O)C5=CC(=CC6=CC=CC=C65)S(=O)(=O)C

InChI

InChI=1S/C40H47Cl2N3O4S2/c1-43(40(46)35-26-32(51(3,48)49)23-29-11-5-6-12-33(29)35)27-31(28-15-16-36(41)37(42)24-28)18-22-45-21-17-30(25-39(45)44-19-9-4-10-20-44)34-13-7-8-14-38(34)50(2)47/h5-8,11-16,23-24,26,30-31,39H,4,9-10,17-22,25,27H2,1-3H3