2-nitro-N-phenyl-3,3-di(piperidin-1-yl)prop-2-enethioamide

Systemtic Name: 2-nitro-N-phenyl-3,3-di(piperidin-1-yl)prop-2-enethioamide Openeye Name: 2-nitro-N-phenyl-3,3-bis(1-piperidyl)prop-2-enethioamide CAS Name: 2-nitro-N-phenyl-3,3-bis(1-piperidinyl)-2-propenethioamide IUPAC Name: 2-nitro-N-phenyl-3,3-di(piperidin-1-yl)prop-2-enethioamide Traditional Name: 2-nitro-N-phenyl-3,3-dipiperidino-thioacrylamide Formula: C19H26N4O2S MolecularWeight: 374.50034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=C(C(=S)NC2=CC=CC=C2)[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

C1CCN(CC1)C(=C(C(=S)NC2=CC=CC=C2)[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C19H26N4O2S/c24-23(25)17(18(26)20-16-10-4-1-5-11-16)19(21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1,4-5,10-11H,2-3,6-9,12-15H2,(H,20,26)