N,N-diethyl-2-[(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-1,3-benzoxazole-5-sulfonamide

Systemtic Name: N,N-diethyl-2-[(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-1,3-benzoxazole-5-sulfonamide Openeye Name: N,N-diethyl-2-[(7-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-1,3-benzoxazole-5-sulfonamide CAS Name: N,N-diethyl-2-[(7-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-1,3-benzoxazole-5-sulfonamide IUPAC Name: N,N-diethyl-2-[(7-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-1,3-benzoxazole-5-sulfonamide Traditional Name: N,N-diethyl-2-[(4-keto-7-methyl-pyrido[1,2-a]pyrimidin-2-yl)methylthio]-1,3-benzoxazole-5-sulfonamide Formula: C21H22N4O4S2 MolecularWeight: 458.55378

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC3=CC(=O)N4C=C(C=CC4=N3)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC3=CC(=O)N4C=C(C=CC4=N3)C

InChI

InChI=1S/C21H22N4O4S2/c1-4-24(5-2)31(27,28)16-7-8-18-17(11-16)23-21(29-18)30-13-15-10-20(26)25-12-14(3)6-9-19(25)22-15/h6-12H,4-5,13H2,1-3H3