4-[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[2-[(6-nitro-1,3-benzothiazol-2-yl)thio]-1-oxoethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetyl]-1,3-dihydroquinoxalin-2-one Formula: C17H12N4O4S2 MolecularWeight: 400.43158

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O4S2/c22-15-8-20(13-4-2-1-3-11(13)18-15)16(23)9-26-17-19-12-6-5-10(21(24)25)7-14(12)27-17/h1-7H,8-9H2,(H,18,22)