N-[2-methyl-5-(propanoylamino)phenyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide

Systemtic Name: N-[2-methyl-5-(propanoylamino)phenyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide Openeye Name: N-[2-methyl-5-(propanoylamino)phenyl]-4-[methyl(2-thienylsulfonyl)amino]butanamide CAS Name: N-[2-methyl-5-(1-oxopropylamino)phenyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide IUPAC Name: N-[2-methyl-5-(propanoylamino)phenyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide Traditional Name: N-(2-methyl-5-propionamido-phenyl)-4-[methyl(2-thienylsulfonyl)amino]butyramide Formula: C19H25N3O4S2 MolecularWeight: 423.5495

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)CCCN(C)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)CCCN(C)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C19H25N3O4S2/c1-4-17(23)20-15-10-9-14(2)16(13-15)21-18(24)7-5-11-22(3)28(25,26)19-8-6-12-27-19/h6,8-10,12-13H,4-5,7,11H2,1-3H3,(H,20,23)(H,21,24)