N-aminocarbonyl-N-butylsulfanyl-2-nitro-benzamide

Systemtic Name: N-aminocarbonyl-N-butylsulfanyl-2-nitro-benzamide Openeye Name: N-butylsulfanyl-N-carbamoyl-2-nitro-benzamide CAS Name: N-(butylthio)-N-carbamoyl-2-nitrobenzamide IUPAC Name: N-butylsulfanyl-N-carbamoyl-2-nitrobenzamide Traditional Name: N-(butylthio)-N-carbamoyl-2-nitro-benzamide Formula: C12H15N3O4S MolecularWeight: 297.3302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSN(C(=O)C1=CC=CC=C1[N+](=O)[O-])C(=O)N

Isomeric SMILES

CCCCSN(C(=O)C1=CC=CC=C1[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C12H15N3O4S/c1-2-3-8-20-14(12(13)17)11(16)9-6-4-5-7-10(9)15(18)19/h4-7H,2-3,8H2,1H3,(H2,13,17)