2-[4-chloranyl-6-(dipropylamino)pyrimidin-2-yl]sulfanyl-N-[1-(phenylmethyl)piperidin-4-yl]ethanamide

Systemtic Name: 2-[4-chloranyl-6-(dipropylamino)pyrimidin-2-yl]sulfanyl-N-[1-(phenylmethyl)piperidin-4-yl]ethanamide Openeye Name: N-(1-benzyl-4-piperidyl)-2-[4-chloro-6-(dipropylamino)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: 2-[[4-chloro-6-(dipropylamino)-2-pyrimidinyl]thio]-N-[1-(phenylmethyl)-4-piperidinyl]acetamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-2-[4-chloro-6-(dipropylamino)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(1-benzyl-4-piperidyl)-2-[[4-chloro-6-(dipropylamino)pyrimidin-2-yl]thio]acetamide Formula: C24H34ClN5OS MolecularWeight: 476.07766

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=CC(=NC(=N1)SCC(=O)NC2CCN(CC2)CC3=CC=CC=C3)Cl

Isomeric SMILES

CCCN(CCC)C1=CC(=NC(=N1)SCC(=O)NC2CCN(CC2)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C24H34ClN5OS/c1-3-12-30(13-4-2)22-16-21(25)27-24(28-22)32-18-23(31)26-20-10-14-29(15-11-20)17-19-8-6-5-7-9-19/h5-9,16,20H,3-4,10-15,17-18H2,1-2H3,(H,26,31)