N-(6-chloranyl-2-phenyl-pyrimidin-4-yl)-2-(4-oxidanyl-4-thiophen-2-yl-piperidin-1-yl)ethanamide

Systemtic Name: N-(6-chloranyl-2-phenyl-pyrimidin-4-yl)-2-(4-oxidanyl-4-thiophen-2-yl-piperidin-1-yl)ethanamide Openeye Name: N-(6-chloro-2-phenyl-pyrimidin-4-yl)-2-[4-hydroxy-4-(2-thienyl)-1-piperidyl]acetamide CAS Name: N-(6-chloro-2-phenyl-4-pyrimidinyl)-2-(4-hydroxy-4-thiophen-2-yl-1-piperidinyl)acetamide IUPAC Name: N-(6-chloro-2-phenylpyrimidin-4-yl)-2-(4-hydroxy-4-thiophen-2-ylpiperidin-1-yl)acetamide Traditional Name: N-(6-chloro-2-phenyl-pyrimidin-4-yl)-2-[4-hydroxy-4-(2-thienyl)piperidino]acetamide Formula: C21H21ClN4O2S MolecularWeight: 428.93504

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CS2)O)CC(=O)NC3=CC(=NC(=N3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CN(CCC1(C2=CC=CS2)O)CC(=O)NC3=CC(=NC(=N3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C21H21ClN4O2S/c22-17-13-18(25-20(23-17)15-5-2-1-3-6-15)24-19(27)14-26-10-8-21(28,9-11-26)16-7-4-12-29-16/h1-7,12-13,28H,8-11,14H2,(H,23,24,25,27)