N-(4-cyclopentylsulfanylphenyl)-2-(4-nitropyrazol-1-yl)ethanamide

Systemtic Name: N-(4-cyclopentylsulfanylphenyl)-2-(4-nitropyrazol-1-yl)ethanamide Openeye Name: N-(4-cyclopentylsulfanylphenyl)-2-(4-nitropyrazol-1-yl)acetamide CAS Name: N-[4-(cyclopentylthio)phenyl]-2-(4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-(4-cyclopentylsulfanylphenyl)-2-(4-nitropyrazol-1-yl)acetamide Traditional Name: N-[4-(cyclopentylthio)phenyl]-2-(4-nitropyrazol-1-yl)acetamide Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=CC=C(C=C2)NC(=O)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)SC2=CC=C(C=C2)NC(=O)CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O3S/c21-16(11-19-10-13(9-17-19)20(22)23)18-12-5-7-15(8-6-12)24-14-3-1-2-4-14/h5-10,14H,1-4,11H2,(H,18,21)