N-[3-[(3-methylbutanoylamino)carbamoyl]naphthalen-2-yl]thiophene-2-sulfonamide

Systemtic Name: N-[3-[(3-methylbutanoylamino)carbamoyl]naphthalen-2-yl]thiophene-2-sulfonamide Openeye Name: N-[3-[(3-methylbutanoylamino)carbamoyl]-2-naphthyl]thiophene-2-sulfonamide CAS Name: N-[3-[[(3-methyl-1-oxobutyl)hydrazo]-oxomethyl]-2-naphthalenyl]-2-thiophenesulfonamide IUPAC Name: N-[3-[(3-methylbutanoylamino)carbamoyl]naphthalen-2-yl]thiophene-2-sulfonamide Traditional Name: N-[3-[(isovalerylamino)carbamoyl]-2-naphthyl]thiophene-2-sulfonamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NNC(=O)C1=CC2=CC=CC=C2C=C1NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C)CC(=O)NNC(=O)C1=CC2=CC=CC=C2C=C1NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H21N3O4S2/c1-13(2)10-18(24)21-22-20(25)16-11-14-6-3-4-7-15(14)12-17(16)23-29(26,27)19-8-5-9-28-19/h3-9,11-13,23H,10H2,1-2H3,(H,21,24)(H,22,25)