N-[bis(azanyl)methylidene]-5-methylsulfonyl-2-nitro-4-pentan-3-yl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-5-methylsulfonyl-2-nitro-4-pentan-3-yl-benzamide Openeye Name: N-(diaminomethylene)-4-(1-ethylpropyl)-5-methylsulfonyl-2-nitro-benzamide CAS Name: N-(diaminomethylidene)-5-methylsulfonyl-2-nitro-4-pentan-3-ylbenzamide IUPAC Name: N-(diaminomethylidene)-5-methylsulfonyl-2-nitro-4-pentan-3-ylbenzamide Traditional Name: N-(diaminomethylene)-4-(1-ethylpropyl)-5-mesyl-2-nitro-benzamide Formula: C14H20N4O5S MolecularWeight: 356.3974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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