4-ethyl-N-[4-(3-methylbutanoylamino)phenyl]-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: 4-ethyl-N-[4-(3-methylbutanoylamino)phenyl]-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: 4-ethyl-N-[4-(3-methylbutanoylamino)phenyl]-3-morpholinosulfonyl-benzamide CAS Name: 4-ethyl-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: 4-ethyl-N-[4-(3-methylbutanoylamino)phenyl]-3-morpholin-4-ylsulfonylbenzamide Traditional Name: 4-ethyl-N-[4-(isovalerylamino)phenyl]-3-morpholinosulfonyl-benzamide Formula: C24H31N3O5S MolecularWeight: 473.58504

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CC(C)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CC(C)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C24H31N3O5S/c1-4-18-5-6-19(16-22(18)33(30,31)27-11-13-32-14-12-27)24(29)26-21-9-7-20(8-10-21)25-23(28)15-17(2)3/h5-10,16-17H,4,11-15H2,1-3H3,(H,25,28)(H,26,29)