3-[4-[[4-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)phenyl]methyl]piperazin-1-yl]propanamide

Systemtic Name: 3-[4-[[4-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)phenyl]methyl]piperazin-1-yl]propanamide Openeye Name: 3-[4-[[4-(4-oxo-6-propyl-1H-pyrimidin-2-yl)phenyl]methyl]piperazin-1-yl]propanamide CAS Name: 3-[4-[[4-(4-oxo-6-propyl-1H-pyrimidin-2-yl)phenyl]methyl]-1-piperazinyl]propanamide IUPAC Name: 3-[4-[[4-(4-oxo-6-propyl-1H-pyrimidin-2-yl)phenyl]methyl]piperazin-1-yl]propanamide Traditional Name: 3-[4-[4-(4-keto-6-propyl-1H-pyrimidin-2-yl)benzyl]piperazino]propionamide Formula: C21H29N5O2 MolecularWeight: 383.48726

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)C2=CC=C(C=C2)CN3CCN(CC3)CCC(=O)N

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)C2=CC=C(C=C2)CN3CCN(CC3)CCC(=O)N

InChI

InChI=1S/C21H29N5O2/c1-2-3-18-14-20(28)24-21(23-18)17-6-4-16(5-7-17)15-26-12-10-25(11-13-26)9-8-19(22)27/h4-7,14H,2-3,8-13,15H2,1H3,(H2,22,27)(H,23,24,28)