4-butyl-3-cyano-N-methyl-6-(2-methylsulfinylphenyl)-2-methylsulfonyl-5-piperidin-1-yl-naphthalene-1-carboxamide

Systemtic Name: 4-butyl-3-cyano-N-methyl-6-(2-methylsulfinylphenyl)-2-methylsulfonyl-5-piperidin-1-yl-naphthalene-1-carboxamide Openeye Name: 4-butyl-3-cyano-N-methyl-6-(2-methylsulfinylphenyl)-2-methylsulfonyl-5-(1-piperidyl)naphthalene-1-carboxamide CAS Name: 4-butyl-3-cyano-N-methyl-6-(2-methylsulfinylphenyl)-2-methylsulfonyl-5-(1-piperidinyl)-1-naphthalenecarboxamide IUPAC Name: 4-butyl-3-cyano-N-methyl-6-(2-methylsulfinylphenyl)-2-methylsulfonyl-5-piperidin-1-ylnaphthalene-1-carboxamide Traditional Name: 4-butyl-3-cyano-2-mesyl-N-methyl-6-(2-methylsulfinylphenyl)-5-piperidino-1-naphthamide Formula: C30H35N3O4S2 MolecularWeight: 565.7466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(C2=C1C(=C(C=C2)C3=CC=CC=C3S(=O)C)N4CCCCC4)C(=O)NC)S(=O)(=O)C)C#N

Isomeric SMILES

CCCCC1=C(C(=C(C2=C1C(=C(C=C2)C3=CC=CC=C3S(=O)C)N4CCCCC4)C(=O)NC)S(=O)(=O)C)C#N

InChI

InChI=1S/C30H35N3O4S2/c1-5-6-12-21-24(19-31)29(39(4,36)37)27(30(34)32-2)23-16-15-22(20-13-8-9-14-25(20)38(3)35)28(26(21)23)33-17-10-7-11-18-33/h8-9,13-16H,5-7,10-12,17-18H2,1-4H3,(H,32,34)