N-[1-[(5-azanyl-1,3-dioxan-2-yl)methyl-methyl-amino]-3-(1H-indol-3-yl)-1-oxidanylidene-butan-2-yl]-1-pyridin-3-yl-piperidine-4-carboxamide

Systemtic Name: N-[1-[(5-azanyl-1,3-dioxan-2-yl)methyl-methyl-amino]-3-(1H-indol-3-yl)-1-oxidanylidene-butan-2-yl]-1-pyridin-3-yl-piperidine-4-carboxamide Openeye Name: N-[1-[(5-amino-1,3-dioxan-2-yl)methyl-methyl-carbamoyl]-2-(1H-indol-3-yl)propyl]-1-(3-pyridyl)piperidine-4-carboxamide CAS Name: N-[1-[(5-amino-1,3-dioxan-2-yl)methyl-methylamino]-3-(1H-indol-3-yl)-1-oxobutan-2-yl]-1-(3-pyridinyl)-4-piperidinecarboxamide IUPAC Name: N-[1-[(5-amino-1,3-dioxan-2-yl)methyl-methylamino]-3-(1H-indol-3-yl)-1-oxobutan-2-yl]-1-pyridin-3-ylpiperidine-4-carboxamide Traditional Name: N-[1-[(5-amino-1,3-dioxan-2-yl)methyl-methyl-carbamoyl]-2-(1H-indol-3-yl)propyl]-1-(3-pyridyl)isonipecotamide Formula: C29H38N6O4 MolecularWeight: 534.64982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CNC2=CC=CC=C21)C(C(=O)N(C)CC3OCC(CO3)N)NC(=O)C4CCN(CC4)C5=CN=CC=C5

Isomeric SMILES

CC(C1=CNC2=CC=CC=C21)C(C(=O)N(C)CC3OCC(CO3)N)NC(=O)C4CCN(CC4)C5=CN=CC=C5

InChI

InChI=1S/C29H38N6O4/c1-19(24-15-32-25-8-4-3-7-23(24)25)27(29(37)34(2)16-26-38-17-21(30)18-39-26)33-28(36)20-9-12-35(13-10-20)22-6-5-11-31-14-22/h3-8,11,14-15,19-21,26-27,32H,9-10,12-13,16-18,30H2,1-2H3,(H,33,36)