3-cyano-N-[2-(4-cyanophenyl)-4-(3-thiomorpholin-4-ylazetidin-1-yl)butyl]-N-methyl-naphthalene-1-carboxamide

Systemtic Name: 3-cyano-N-[2-(4-cyanophenyl)-4-(3-thiomorpholin-4-ylazetidin-1-yl)butyl]-N-methyl-naphthalene-1-carboxamide Openeye Name: 3-cyano-N-[2-(4-cyanophenyl)-4-(3-thiomorpholinoazetidin-1-yl)butyl]-N-methyl-naphthalene-1-carboxamide CAS Name: 3-cyano-N-[2-(4-cyanophenyl)-4-(3-thiomorpholin-4-yl-1-azetidinyl)butyl]-N-methyl-1-naphthalenecarboxamide IUPAC Name: 3-cyano-N-[2-(4-cyanophenyl)-4-(3-thiomorpholin-4-ylazetidin-1-yl)butyl]-N-methylnaphthalene-1-carboxamide Traditional Name: 3-cyano-N-[2-(4-cyanophenyl)-4-(3-thiomorpholinoazetidin-1-yl)butyl]-N-methyl-1-naphthamide Formula: C31H33N5OS MolecularWeight: 523.69162

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(CCN1CC(C1)N2CCSCC2)C3=CC=C(C=C3)C#N)C(=O)C4=CC(=CC5=CC=CC=C54)C#N

Isomeric SMILES

CN(CC(CCN1CC(C1)N2CCSCC2)C3=CC=C(C=C3)C#N)C(=O)C4=CC(=CC5=CC=CC=C54)C#N

InChI

InChI=1S/C31H33N5OS/c1-34(31(37)30-17-24(19-33)16-26-4-2-3-5-29(26)30)20-27(25-8-6-23(18-32)7-9-25)10-11-35-21-28(22-35)36-12-14-38-15-13-36/h2-9,16-17,27-28H,10-15,20-22H2,1H3