N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[(4-methylphenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[(4-methylphenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-methyl-N-methylsulfonyl-anilino)butanamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-(4-methyl-N-methylsulfonylanilino)butanamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-methyl-N-methylsulfonylanilino)butanamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(N-mesyl-4-methyl-anilino)butyramide Formula: C24H33N3O5S2 MolecularWeight: 507.66592

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2)N(C3=CC=C(C=C3)C)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2)N(C3=CC=C(C=C3)C)S(=O)(=O)C

InChI

InChI=1S/C24H33N3O5S2/c1-4-23(27(33(3,29)30)21-13-9-19(2)10-14-21)24(28)25-20-11-15-22(16-12-20)34(31,32)26-17-7-5-6-8-18-26/h9-16,23H,4-8,17-18H2,1-3H3,(H,25,28)