N-[3-(3H-benzimidazol-5-yl)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]-5-(dimethylamino)naphthalene-1-sulfonamide

Systemtic Name: N-[3-(3H-benzimidazol-5-yl)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]-5-(dimethylamino)naphthalene-1-sulfonamide Openeye Name: N-[1-(3H-benzimidazol-5-ylmethyl)-2-(4-methyl-1-piperidyl)-2-oxo-ethyl]-5-(dimethylamino)naphthalene-1-sulfonamide CAS Name: N-[3-(3H-benzimidazol-5-yl)-1-(4-methyl-1-piperidinyl)-1-oxopropan-2-yl]-5-(dimethylamino)-1-naphthalenesulfonamide IUPAC Name: N-[3-(3H-benzimidazol-5-yl)-1-(4-methylpiperidin-1-yl)-1-oxopropan-2-yl]-5-(dimethylamino)naphthalene-1-sulfonamide Traditional Name: N-[1-(3H-benzimidazol-5-ylmethyl)-2-keto-2-(4-methylpiperidino)ethyl]-5-(dimethylamino)naphthalene-1-sulfonamide Formula: C28H33N5O3S MolecularWeight: 519.65832

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(CC2=CC3=C(C=C2)N=CN3)NS(=O)(=O)C4=CC=CC5=C4C=CC=C5N(C)C

Isomeric SMILES

CC1CCN(CC1)C(=O)C(CC2=CC3=C(C=C2)N=CN3)NS(=O)(=O)C4=CC=CC5=C4C=CC=C5N(C)C

InChI

InChI=1S/C28H33N5O3S/c1-19-12-14-33(15-13-19)28(34)25(17-20-10-11-23-24(16-20)30-18-29-23)31-37(35,36)27-9-5-6-21-22(27)7-4-8-26(21)32(2)3/h4-11,16,18-19,25,31H,12-15,17H2,1-3H3,(H,29,30)