3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]propanamide

Systemtic Name: 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]propanamide Openeye Name: 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]propanamide CAS Name: 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]propanamide IUPAC Name: 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]propanamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]propionamide Formula: C27H27N5O3 MolecularWeight: 469.53498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)CCC(=O)NC4=CN=C(C=C4)N5CCNC(=O)C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)CCC(=O)NC4=CN=C(C=C4)N5CCNC(=O)C5

InChI

InChI=1S/C27H27N5O3/c1-35-20-9-6-18(7-10-20)27-22(21-4-2-3-5-23(21)31-27)11-13-25(33)30-19-8-12-24(29-16-19)32-15-14-28-26(34)17-32/h2-10,12,16,31H,11,13-15,17H2,1H3,(H,28,34)(H,30,33)