(2E)-2-[[4-(azepan-1-ylsulfonyl)phenyl]hydrazinylidene]-2-cyano-ethanamide

Systemtic Name: (2E)-2-[[4-(azepan-1-ylsulfonyl)phenyl]hydrazinylidene]-2-cyano-ethanamide Openeye Name: (1E)-2-amino-N-[4-(azepan-1-ylsulfonyl)anilino]-2-oxo-acetimidoyl cyanide CAS Name: (2E)-2-[[4-(1-azepanylsulfonyl)phenyl]hydrazinylidene]-2-cyanoacetamide IUPAC Name: (1E)-2-amino-N-[4-(azepan-1-ylsulfonyl)anilino]-2-oxoethanimidoyl cyanide Traditional Name: (2E)-2-[[4-(azepan-1-ylsulfonyl)phenyl]hydrazono]-2-cyano-acetamide Formula: C15H19N5O3S MolecularWeight: 349.40806

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NN=C(C#N)C(=O)N

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N/N=C(\C#N)/C(=O)N

InChI

InChI=1S/C15H19N5O3S/c16-11-14(15(17)21)19-18-12-5-7-13(8-6-12)24(22,23)20-9-3-1-2-4-10-20/h5-8,18H,1-4,9-10H2,(H2,17,21)/b19-14+