2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]ethanamide

Systemtic Name: 2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]ethanamide Openeye Name: 2-(6-nitro-4-oxo-quinazolin-3-yl)-N-[2-(2-thienylmethylsulfanyl)ethyl]acetamide CAS Name: 2-(6-nitro-4-oxo-3-quinazolinyl)-N-[2-(thiophen-2-ylmethylthio)ethyl]acetamide IUPAC Name: 2-(6-nitro-4-oxoquinazolin-3-yl)-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]acetamide Traditional Name: 2-(4-keto-6-nitro-quinazolin-3-yl)-N-[2-(2-thenylthio)ethyl]acetamide Formula: C17H16N4O4S2 MolecularWeight: 404.46334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CSCCNC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)CSCCNC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O4S2/c22-16(18-5-7-26-10-13-2-1-6-27-13)9-20-11-19-15-4-3-12(21(24)25)8-14(15)17(20)23/h1-4,6,8,11H,5,7,9-10H2,(H,18,22)