N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)-4-(5-methyl-3-nitro-pyrazol-1-yl)butanamide

Systemtic Name: N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)-4-(5-methyl-3-nitro-pyrazol-1-yl)butanamide Openeye Name: N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-4-(5-methyl-3-nitro-pyrazol-1-yl)butanamide CAS Name: N-(3-cyano-4-ethyl-5-methyl-2-thiophenyl)-4-(5-methyl-3-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-4-(5-methyl-3-nitropyrazol-1-yl)butanamide Traditional Name: N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-4-(5-methyl-3-nitro-pyrazol-1-yl)butyramide Formula: C16H19N5O3S MolecularWeight: 361.41876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C#N)NC(=O)CCCN2C(=CC(=N2)[N+](=O)[O-])C)C

Isomeric SMILES

CCC1=C(SC(=C1C#N)NC(=O)CCCN2C(=CC(=N2)[N+](=O)[O-])C)C

InChI

InChI=1S/C16H19N5O3S/c1-4-12-11(3)25-16(13(12)9-17)18-15(22)6-5-7-20-10(2)8-14(19-20)21(23)24/h8H,4-7H2,1-3H3,(H,18,22)