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

Systemtic Name: N-[bis(azanyl)methylidene]-2-methyl-5-nitro-4-propan-2-ylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-4-isopropylsulfonyl-2-methyl-5-nitro-benzamide CAS Name: N-(diaminomethylidene)-2-methyl-5-nitro-4-propan-2-ylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-2-methyl-5-nitro-4-propan-2-ylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-4-isopropylsulfonyl-2-methyl-5-nitro-benzamide Formula: C12H16N4O5S MolecularWeight: 328.34424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)N=C(N)N)[N+](=O)[O-])S(=O)(=O)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)N=C(N)N)[N+](=O)[O-])S(=O)(=O)C(C)C

InChI

InChI=1S/C12H16N4O5S/c1-6(2)22(20,21)10-4-7(3)8(5-9(10)16(18)19)11(17)15-12(13)14/h4-6H,1-3H3,(H4,13,14,15,17)