methyl 3-(oxolan-3-ylcarbonylamino)-1-phenethyl-5-[(1-propylpiperidin-4-yl)amino]pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 3-(oxolan-3-ylcarbonylamino)-1-phenethyl-5-[(1-propylpiperidin-4-yl)amino]pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 1-phenethyl-5-[(1-propyl-4-piperidyl)amino]-3-(tetrahydrofuran-3-carbonylamino)pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 3-[[oxo(3-oxolanyl)methyl]amino]-1-phenethyl-5-[(1-propyl-4-piperidinyl)amino]-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-(oxolane-3-carbonylamino)-1-phenethyl-5-[(1-propylpiperidin-4-yl)amino]pyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 1-phenethyl-5-[(1-propyl-4-piperidyl)amino]-3-(tetrahydrofuran-3-carbonylamino)pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C30H39N5O4 MolecularWeight: 533.66176

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)NC2=CN=C3C(=C2)C(=C(N3CCC4=CC=CC=C4)C(=O)OC)NC(=O)C5CCOC5

Isomeric SMILES

CCCN1CCC(CC1)NC2=CN=C3C(=C2)C(=C(N3CCC4=CC=CC=C4)C(=O)OC)NC(=O)C5CCOC5

InChI

InChI=1S/C30H39N5O4/c1-3-13-34-14-10-23(11-15-34)32-24-18-25-26(33-29(36)22-12-17-39-20-22)27(30(37)38-2)35(28(25)31-19-24)16-9-21-7-5-4-6-8-21/h4-8,18-19,22-23,32H,3,9-17,20H2,1-2H3,(H,33,36)