N-(1-cyclopropylcarbonylpiperidin-4-yl)-2-(4-nitrophenyl)sulfanyl-ethanamide

Systemtic Name: N-(1-cyclopropylcarbonylpiperidin-4-yl)-2-(4-nitrophenyl)sulfanyl-ethanamide Openeye Name: N-[1-(cyclopropanecarbonyl)-4-piperidyl]-2-(4-nitrophenyl)sulfanyl-acetamide CAS Name: N-[1-[cyclopropyl(oxo)methyl]-4-piperidinyl]-2-[(4-nitrophenyl)thio]acetamide IUPAC Name: N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-2-(4-nitrophenyl)sulfanylacetamide Traditional Name: N-[1-(cyclopropanecarbonyl)-4-piperidyl]-2-[(4-nitrophenyl)thio]acetamide Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCC(CC2)NC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC1C(=O)N2CCC(CC2)NC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O4S/c21-16(11-25-15-5-3-14(4-6-15)20(23)24)18-13-7-9-19(10-8-13)17(22)12-1-2-12/h3-6,12-13H,1-2,7-11H2,(H,18,21)