N-[3-[4-(2-methylpropanoyl)piperazin-1-yl]-3-oxidanylidene-propyl]naphthalene-2-sulfonamide

Systemtic Name: N-[3-[4-(2-methylpropanoyl)piperazin-1-yl]-3-oxidanylidene-propyl]naphthalene-2-sulfonamide Openeye Name: N-[3-[4-(2-methylpropanoyl)piperazin-1-yl]-3-oxo-propyl]naphthalene-2-sulfonamide CAS Name: N-[3-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-3-oxopropyl]-2-naphthalenesulfonamide IUPAC Name: N-[3-[4-(2-methylpropanoyl)piperazin-1-yl]-3-oxopropyl]naphthalene-2-sulfonamide Traditional Name: N-[3-(4-isobutyrylpiperazino)-3-keto-propyl]naphthalene-2-sulfonamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)CCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)CCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H27N3O4S/c1-16(2)21(26)24-13-11-23(12-14-24)20(25)9-10-22-29(27,28)19-8-7-17-5-3-4-6-18(17)15-19/h3-8,15-16,22H,9-14H2,1-2H3