butyl 2-[[3-(1-propylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]carbamoylamino]benzoate

Systemtic Name: butyl 2-[[3-(1-propylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]carbamoylamino]benzoate Openeye Name: butyl 2-[[3-(1-propyl-4-piperidyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]carbamoylamino]benzoate CAS Name: 2-[[oxo-[[3-(1-propyl-4-piperidinyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]amino]methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 2-[[3-(1-propylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]carbamoylamino]benzoate Traditional Name: 2-[[3-(1-propyl-4-piperidyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]carbamoylamino]benzoic acid butyl ester Formula: C27H35N5O3 MolecularWeight: 477.5985

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=CC=C1NC(=O)NC2=NC3=C(C=C2)NC=C3C4CCN(CC4)CCC

Isomeric SMILES

CCCCOC(=O)C1=CC=CC=C1NC(=O)NC2=NC3=C(C=C2)NC=C3C4CCN(CC4)CCC

InChI

InChI=1S/C27H35N5O3/c1-3-5-17-35-26(33)20-8-6-7-9-22(20)29-27(34)31-24-11-10-23-25(30-24)21(18-28-23)19-12-15-32(14-4-2)16-13-19/h6-11,18-19,28H,3-5,12-17H2,1-2H3,(H2,29,30,31,34)