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

Systemtic Name: N-[bis(azanyl)methylidene]-4-butyl-3-methylsulfonyl-2-propyl-benzamide Openeye Name: 4-butyl-N-(diaminomethylene)-3-methylsulfonyl-2-propyl-benzamide CAS Name: 4-butyl-N-(diaminomethylidene)-3-methylsulfonyl-2-propylbenzamide IUPAC Name: 4-butyl-N-(diaminomethylidene)-3-methylsulfonyl-2-propylbenzamide Traditional Name: 4-butyl-N-(diaminomethylene)-3-mesyl-2-propyl-benzamide Formula: C16H25N3O3S MolecularWeight: 339.453

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(C=C1)C(=O)N=C(N)N)CCC)S(=O)(=O)C

Isomeric SMILES

CCCCC1=C(C(=C(C=C1)C(=O)N=C(N)N)CCC)S(=O)(=O)C

InChI

InChI=1S/C16H25N3O3S/c1-4-6-8-11-9-10-13(15(20)19-16(17)18)12(7-5-2)14(11)23(3,21)22/h9-10H,4-8H2,1-3H3,(H4,17,18,19,20)