N-[4-(2-cyanopropan-2-yl)phenyl]-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[4-(2-cyanopropan-2-yl)phenyl]-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[4-(1-cyano-1-methyl-ethyl)phenyl]-3-morpholinosulfonyl-benzamide CAS Name: N-[4-(2-cyanopropan-2-yl)phenyl]-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[4-(2-cyanopropan-2-yl)phenyl]-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[4-(1-cyano-1-methyl-ethyl)phenyl]-3-morpholinosulfonyl-benzamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C)(C#N)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H23N3O4S/c1-21(2,15-22)17-6-8-18(9-7-17)23-20(25)16-4-3-5-19(14-16)29(26,27)24-10-12-28-13-11-24/h3-9,14H,10-13H2,1-2H3,(H,23,25)