N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3-methoxy-4-nitro-pyrazol-1-yl)ethanamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3-methoxy-4-nitro-pyrazol-1-yl)ethanamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(3-methoxy-4-nitro-pyrazol-1-yl)acetamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3-methoxy-4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3-methoxy-4-nitropyrazol-1-yl)acetamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(3-methoxy-4-nitro-pyrazol-1-yl)acetamide Formula: C15H15N5O4S MolecularWeight: 361.3757

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C=C1[N+](=O)[O-])CC(=O)NC2=C(C3=C(S2)CCCC3)C#N

Isomeric SMILES

COC1=NN(C=C1[N+](=O)[O-])CC(=O)NC2=C(C3=C(S2)CCCC3)C#N

InChI

InChI=1S/C15H15N5O4S/c1-24-14-11(20(22)23)7-19(18-14)8-13(21)17-15-10(6-16)9-4-2-3-5-12(9)25-15/h7H,2-5,8H2,1H3,(H,17,21)