N-[3-(3H-benzimidazol-5-yl)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]-3-methyl-quinoline-8-sulfonamide

Systemtic Name: N-[3-(3H-benzimidazol-5-yl)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]-3-methyl-quinoline-8-sulfonamide Openeye Name: N-[1-(3H-benzimidazol-5-ylmethyl)-2-(4-methyl-1-piperidyl)-2-oxo-ethyl]-3-methyl-quinoline-8-sulfonamide CAS Name: N-[3-(3H-benzimidazol-5-yl)-1-(4-methyl-1-piperidinyl)-1-oxopropan-2-yl]-3-methyl-8-quinolinesulfonamide IUPAC Name: N-[3-(3H-benzimidazol-5-yl)-1-(4-methylpiperidin-1-yl)-1-oxopropan-2-yl]-3-methylquinoline-8-sulfonamide Traditional Name: N-[1-(3H-benzimidazol-5-ylmethyl)-2-keto-2-(4-methylpiperidino)ethyl]-3-methyl-quinoline-8-sulfonamide Formula: C26H29N5O3S MolecularWeight: 491.60516

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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=CC(=CN=C54)C

Isomeric SMILES

CC1CCN(CC1)C(=O)C(CC2=CC3=C(C=C2)N=CN3)NS(=O)(=O)C4=CC=CC5=CC(=CN=C54)C

InChI

InChI=1S/C26H29N5O3S/c1-17-8-10-31(11-9-17)26(32)23(14-19-6-7-21-22(13-19)29-16-28-21)30-35(33,34)24-5-3-4-20-12-18(2)15-27-25(20)24/h3-7,12-13,15-17,23,30H,8-11,14H2,1-2H3,(H,28,29)