4-[2-(1-azanyl-1-oxidanylidene-propan-2-yl)oxypyrimidin-4-yl]-N-[2-(3-cyano-1H-indol-5-yl)ethyl]benzamide

Systemtic Name: 4-[2-(1-azanyl-1-oxidanylidene-propan-2-yl)oxypyrimidin-4-yl]-N-[2-(3-cyano-1H-indol-5-yl)ethyl]benzamide Openeye Name: 4-[2-(2-amino-1-methyl-2-oxo-ethoxy)pyrimidin-4-yl]-N-[2-(3-cyano-1H-indol-5-yl)ethyl]benzamide CAS Name: 4-[2-(1-amino-1-oxopropan-2-yl)oxy-4-pyrimidinyl]-N-[2-(3-cyano-1H-indol-5-yl)ethyl]benzamide IUPAC Name: 4-[2-(1-amino-1-oxopropan-2-yl)oxypyrimidin-4-yl]-N-[2-(3-cyano-1H-indol-5-yl)ethyl]benzamide Traditional Name: 4-[2-(2-amino-2-keto-1-methyl-ethoxy)pyrimidin-4-yl]-N-[2-(3-cyano-1H-indol-5-yl)ethyl]benzamide Formula: C25H22N6O3 MolecularWeight: 454.48058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC1=NC=CC(=N1)C2=CC=C(C=C2)C(=O)NCCC3=CC4=C(C=C3)NC=C4C#N

Isomeric SMILES

CC(C(=O)N)OC1=NC=CC(=N1)C2=CC=C(C=C2)C(=O)NCCC3=CC4=C(C=C3)NC=C4C#N

InChI

InChI=1S/C25H22N6O3/c1-15(23(27)32)34-25-29-11-9-21(31-25)17-3-5-18(6-4-17)24(33)28-10-8-16-2-7-22-20(12-16)19(13-26)14-30-22/h2-7,9,11-12,14-15,30H,8,10H2,1H3,(H2,27,32)(H,28,33)