2-(4-nitrophenyl)-5-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Systemtic Name: 2-(4-nitrophenyl)-5-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: 2-(4-nitrophenyl)-5-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: 2-(4-nitrophenyl)-5-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: 2-(4-nitrophenyl)-5-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: 2-(4-nitrophenyl)-5-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C17H10N4O3S MolecularWeight: 350.3513

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)N=C3N2N=C(S3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)N=C3N2N=C(S3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H10N4O3S/c22-15-10-14(11-4-2-1-3-5-11)20-17(18-15)25-16(19-20)12-6-8-13(9-7-12)21(23)24/h1-10H