N-tert-butyl-2-[(7-chloranyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]propanamide

Systemtic Name: N-tert-butyl-2-[(7-chloranyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]propanamide Openeye Name: N-tert-butyl-2-[(7-chloro-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]propanamide CAS Name: N-tert-butyl-2-[(7-chloro-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]propanamide IUPAC Name: N-tert-butyl-2-[(7-chloro-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]propanamide Traditional Name: N-tert-butyl-2-[(7-chloro-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methylthio]propionamide Formula: C16H20ClN3O2S MolecularWeight: 353.8669

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)SCC1=CC(=O)N2C=C(C=CC2=N1)Cl

Isomeric SMILES

CC(C(=O)NC(C)(C)C)SCC1=CC(=O)N2C=C(C=CC2=N1)Cl

InChI

InChI=1S/C16H20ClN3O2S/c1-10(15(22)19-16(2,3)4)23-9-12-7-14(21)20-8-11(17)5-6-13(20)18-12/h5-8,10H,9H2,1-4H3,(H,19,22)