2-(4-nitrophenyl)carbonyl-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one

Systemtic Name: 2-(4-nitrophenyl)carbonyl-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one Openeye Name: 2-(4-nitrobenzoyl)-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one CAS Name: 2-[(4-nitrophenyl)-oxomethyl]-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one IUPAC Name: 2-(4-nitrobenzoyl)-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one Traditional Name: 2-(4-nitrobenzoyl)-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one Formula: C16H8N4O4S MolecularWeight: 352.32412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C3N2N=C(S3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C3N2N=C(S3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H8N4O4S/c21-13(9-5-7-10(8-6-9)20(23)24)15-18-19-12-4-2-1-3-11(12)14(22)17-16(19)25-15/h1-8H