N-[3-(1-butylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-2-methylsulfonyl-benzamide

Systemtic Name: N-[3-(1-butylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-2-methylsulfonyl-benzamide Openeye Name: N-[3-(1-butyl-4-piperidyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-2-methylsulfonyl-benzamide CAS Name: N-[3-(1-butyl-4-piperidinyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-2-methylsulfonylbenzamide IUPAC Name: N-[3-(1-butylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-2-methylsulfonylbenzamide Traditional Name: N-[3-(1-butyl-4-piperidyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-2-mesyl-benzamide Formula: C24H30N4O3S MolecularWeight: 454.585

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)C2=CNC3=C2N=C(C=C3)NC(=O)C4=CC=CC=C4S(=O)(=O)C

Isomeric SMILES

CCCCN1CCC(CC1)C2=CNC3=C2N=C(C=C3)NC(=O)C4=CC=CC=C4S(=O)(=O)C

InChI

InChI=1S/C24H30N4O3S/c1-3-4-13-28-14-11-17(12-15-28)19-16-25-20-9-10-22(26-23(19)20)27-24(29)18-7-5-6-8-21(18)32(2,30)31/h5-10,16-17,25H,3-4,11-15H2,1-2H3,(H,26,27,29)