3-methyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonyl-phenyl]benzamide

Systemtic Name: 3-methyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonyl-phenyl]benzamide Openeye Name: N-[2-(isobutylamino)-5-morpholinosulfonyl-phenyl]-3-methyl-benzamide CAS Name: 3-methyl-N-[2-(2-methylpropylamino)-5-(4-morpholinylsulfonyl)phenyl]benzamide IUPAC Name: 3-methyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]benzamide Traditional Name: N-[2-(isobutylamino)-5-morpholinosulfonyl-phenyl]-3-methyl-benzamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)NCC(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)NCC(C)C

InChI

InChI=1S/C22H29N3O4S/c1-16(2)15-23-20-8-7-19(30(27,28)25-9-11-29-12-10-25)14-21(20)24-22(26)18-6-4-5-17(3)13-18/h4-8,13-14,16,23H,9-12,15H2,1-3H3,(H,24,26)