2-[4-chloranyl-6-[(phenylmethyl)amino]pyrimidin-2-yl]sulfanyl-N-(2-hydroxyethyl)ethanamide

Systemtic Name: 2-[4-chloranyl-6-[(phenylmethyl)amino]pyrimidin-2-yl]sulfanyl-N-(2-hydroxyethyl)ethanamide Openeye Name: 2-[4-(benzylamino)-6-chloro-pyrimidin-2-yl]sulfanyl-N-(2-hydroxyethyl)acetamide CAS Name: 2-[[4-chloro-6-[(phenylmethyl)amino]-2-pyrimidinyl]thio]-N-(2-hydroxyethyl)acetamide IUPAC Name: 2-[4-(benzylamino)-6-chloropyrimidin-2-yl]sulfanyl-N-(2-hydroxyethyl)acetamide Traditional Name: 2-[[4-(benzylamino)-6-chloro-pyrimidin-2-yl]thio]-N-(2-hydroxyethyl)acetamide Formula: C15H17ClN4O2S MolecularWeight: 352.83908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=CC(=NC(=N2)SCC(=O)NCCO)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=CC(=NC(=N2)SCC(=O)NCCO)Cl

InChI

InChI=1S/C15H17ClN4O2S/c16-12-8-13(18-9-11-4-2-1-3-5-11)20-15(19-12)23-10-14(22)17-6-7-21/h1-5,8,21H,6-7,9-10H2,(H,17,22)(H,18,19,20)