N-(4-tert-butylphenyl)-2-[(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]ethanamide

Systemtic Name: N-(4-tert-butylphenyl)-2-[(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]ethanamide Openeye Name: N-(4-tert-butylphenyl)-2-[(7-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]acetamide CAS Name: N-(4-tert-butylphenyl)-2-[(7-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]acetamide IUPAC Name: N-(4-tert-butylphenyl)-2-[(7-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]acetamide Traditional Name: N-(4-tert-butylphenyl)-2-[(4-keto-7-methyl-pyrido[1,2-a]pyrimidin-2-yl)methylthio]acetamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)CSCC(=O)NC3=CC=C(C=C3)C(C)(C)C)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)CSCC(=O)NC3=CC=C(C=C3)C(C)(C)C)C=C1

InChI

InChI=1S/C22H25N3O2S/c1-15-5-10-19-23-18(11-21(27)25(19)12-15)13-28-14-20(26)24-17-8-6-16(7-9-17)22(2,3)4/h5-12H,13-14H2,1-4H3,(H,24,26)