N-[bis(azanyl)methylidene]-2-methyl-5-nitro-4-pentan-2-ylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-methyl-5-nitro-4-pentan-2-ylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-2-methyl-4-(1-methylbutylsulfonyl)-5-nitro-benzamide CAS Name: N-(diaminomethylidene)-2-methyl-5-nitro-4-pentan-2-ylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-2-methyl-5-nitro-4-pentan-2-ylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-2-methyl-4-(1-methylbutylsulfonyl)-5-nitro-benzamide Formula: C14H20N4O5S MolecularWeight: 356.3974

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)S(=O)(=O)C1=C(C=C(C(=C1)C)C(=O)N=C(N)N)[N+](=O)[O-]

Isomeric SMILES

CCCC(C)S(=O)(=O)C1=C(C=C(C(=C1)C)C(=O)N=C(N)N)[N+](=O)[O-]

InChI

InChI=1S/C14H20N4O5S/c1-4-5-9(3)24(22,23)12-6-8(2)10(7-11(12)18(20)21)13(19)17-14(15)16/h6-7,9H,4-5H2,1-3H3,(H4,15,16,17,19)