3-nitro-N-[(E)-(4-oxidanylidene-2-phenylsulfanyl-pyrido[1,2-a]pyrimidin-3-yl)methylideneamino]benzamide

Systemtic Name: 3-nitro-N-[(E)-(4-oxidanylidene-2-phenylsulfanyl-pyrido[1,2-a]pyrimidin-3-yl)methylideneamino]benzamide Openeye Name: 3-nitro-N-[(E)-(4-oxo-2-phenylsulfanyl-pyrido[1,2-a]pyrimidin-3-yl)methyleneamino]benzamide CAS Name: 3-nitro-N-[(E)-[4-oxo-2-(phenylthio)-3-pyrido[1,2-a]pyrimidinyl]methylideneamino]benzamide IUPAC Name: 3-nitro-N-[(E)-(4-oxo-2-phenylsulfanylpyrido[1,2-a]pyrimidin-3-yl)methylideneamino]benzamide Traditional Name: N-[(E)-[4-keto-2-(phenylthio)pyrido[1,2-a]pyrimidin-3-yl]methyleneamino]-3-nitro-benzamide Formula: C22H15N5O4S MolecularWeight: 445.4506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(C(=O)N3C=CC=CC3=N2)C=NNC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(C(=O)N3C=CC=CC3=N2)/C=N/NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H15N5O4S/c28-20(15-7-6-8-16(13-15)27(30)31)25-23-14-18-21(32-17-9-2-1-3-10-17)24-19-11-4-5-12-26(19)22(18)29/h1-14H,(H,25,28)/b23-14+