2-[4-(5-azanylidene-1,2,4-dithiazol-3-yl)-3-nitro-phenyl]-2,3-dihydro-1H-quinazolin-4-one

Systemtic Name: 2-[4-(5-azanylidene-1,2,4-dithiazol-3-yl)-3-nitro-phenyl]-2,3-dihydro-1H-quinazolin-4-one Openeye Name: 2-[4-(5-imino-1,2,4-dithiazol-3-yl)-3-nitro-phenyl]-2,3-dihydro-1H-quinazolin-4-one CAS Name: 2-[4-(5-imino-1,2,4-dithiazol-3-yl)-3-nitrophenyl]-2,3-dihydro-1H-quinazolin-4-one IUPAC Name: 2-[4-(5-imino-1,2,4-dithiazol-3-yl)-3-nitrophenyl]-2,3-dihydro-1H-quinazolin-4-one Traditional Name: 2-[4-(5-imino-1,2,4-dithiazol-3-yl)-3-nitro-phenyl]-2,3-dihydro-1H-quinazolin-4-one Formula: C16H11N5O3S2 MolecularWeight: 385.42024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC(N2)C3=CC(=C(C=C3)C4=NC(=N)SS4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NC(N2)C3=CC(=C(C=C3)C4=NC(=N)SS4)[N+](=O)[O-]

InChI

InChI=1S/C16H11N5O3S2/c17-16-20-15(25-26-16)10-6-5-8(7-12(10)21(23)24)13-18-11-4-2-1-3-9(11)14(22)19-13/h1-7,13,17-18H,(H,19,22)