3-(6-oxidanylidene-3H-purin-9-yl)-N-[1-(phenylmethyl)piperidin-4-yl]propanamide

Systemtic Name: 3-(6-oxidanylidene-3H-purin-9-yl)-N-[1-(phenylmethyl)piperidin-4-yl]propanamide Openeye Name: N-(1-benzyl-4-piperidyl)-3-(6-oxo-3H-purin-9-yl)propanamide CAS Name: 3-(6-oxo-3H-purin-9-yl)-N-[1-(phenylmethyl)-4-piperidinyl]propanamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-3-(6-oxo-3H-purin-9-yl)propanamide Traditional Name: N-(1-benzyl-4-piperidyl)-3-(6-keto-3H-purin-9-yl)propionamide Formula: C20H24N6O2 MolecularWeight: 380.44356

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)CCN2C=NC3=C2NC=NC3=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)CCN2C=NC3=C2NC=NC3=O)CC4=CC=CC=C4

InChI

InChI=1S/C20H24N6O2/c27-17(8-11-26-14-23-18-19(26)21-13-22-20(18)28)24-16-6-9-25(10-7-16)12-15-4-2-1-3-5-15/h1-5,13-14,16H,6-12H2,(H,24,27)(H,21,22,28)