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

Systemtic Name: N-(1-cyclopropylcarbonylpiperidin-4-yl)-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: N-[1-(cyclopropanecarbonyl)-4-piperidyl]-2-(4-nitrophenyl)sulfanyl-propanamide CAS Name: N-[1-[cyclopropyl(oxo)methyl]-4-piperidinyl]-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: N-[1-(cyclopropanecarbonyl)-4-piperidyl]-2-[(4-nitrophenyl)thio]propionamide Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCN(CC1)C(=O)C2CC2)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1CCN(CC1)C(=O)C2CC2)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O4S/c1-12(26-16-6-4-15(5-7-16)21(24)25)17(22)19-14-8-10-20(11-9-14)18(23)13-2-3-13/h4-7,12-14H,2-3,8-11H2,1H3,(H,19,22)