3-methyl-N-[(E)-pyridin-3-ylmethylideneamino]-2-(2-thiophen-2-ylethanoylamino)butanamide

Systemtic Name: 3-methyl-N-[(E)-pyridin-3-ylmethylideneamino]-2-(2-thiophen-2-ylethanoylamino)butanamide Openeye Name: 3-methyl-N-[(E)-3-pyridylmethyleneamino]-2-[[2-(2-thienyl)acetyl]amino]butanamide CAS Name: 3-methyl-2-[(1-oxo-2-thiophen-2-ylethyl)amino]-N-[(E)-3-pyridinylmethylideneamino]butanamide IUPAC Name: 3-methyl-N-[(E)-pyridin-3-ylmethylideneamino]-2-[(2-thiophen-2-ylacetyl)amino]butanamide Traditional Name: 3-methyl-N-[(E)-3-pyridylmethyleneamino]-2-[[2-(2-thienyl)acetyl]amino]butyramide Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NN=CC1=CN=CC=C1)NC(=O)CC2=CC=CS2

Isomeric SMILES

CC(C)C(C(=O)N/N=C/C1=CN=CC=C1)NC(=O)CC2=CC=CS2

InChI

InChI=1S/C17H20N4O2S/c1-12(2)16(20-15(22)9-14-6-4-8-24-14)17(23)21-19-11-13-5-3-7-18-10-13/h3-8,10-12,16H,9H2,1-2H3,(H,20,22)(H,21,23)/b19-11+