N-[bis(azanyl)methylidene]-3-methylsulfonyl-4-pentyl-2-propyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-3-methylsulfonyl-4-pentyl-2-propyl-benzamide Openeye Name: N-(diaminomethylene)-3-methylsulfonyl-4-pentyl-2-propyl-benzamide CAS Name: N-(diaminomethylidene)-3-methylsulfonyl-4-pentyl-2-propylbenzamide IUPAC Name: N-(diaminomethylidene)-3-methylsulfonyl-4-pentyl-2-propylbenzamide Traditional Name: 4-amyl-N-(diaminomethylene)-3-mesyl-2-propyl-benzamide Formula: C17H27N3O3S MolecularWeight: 353.47958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(C=C1)C(=O)N=C(N)N)CCC)S(=O)(=O)C

Isomeric SMILES

CCCCCC1=C(C(=C(C=C1)C(=O)N=C(N)N)CCC)S(=O)(=O)C

InChI

InChI=1S/C17H27N3O3S/c1-4-6-7-9-12-10-11-14(16(21)20-17(18)19)13(8-5-2)15(12)24(3,22)23/h10-11H,4-9H2,1-3H3,(H4,18,19,20,21)