4-[2-(4-nitrophenyl)sulfanylethanoylamino]-N-phenyl-piperidine-1-carboxamide

Systemtic Name: 4-[2-(4-nitrophenyl)sulfanylethanoylamino]-N-phenyl-piperidine-1-carboxamide Openeye Name: 4-[[2-(4-nitrophenyl)sulfanylacetyl]amino]-N-phenyl-piperidine-1-carboxamide CAS Name: 4-[[2-[(4-nitrophenyl)thio]-1-oxoethyl]amino]-N-phenyl-1-piperidinecarboxamide IUPAC Name: 4-[[2-(4-nitrophenyl)sulfanylacetyl]amino]-N-phenylpiperidine-1-carboxamide Traditional Name: 4-[[2-[(4-nitrophenyl)thio]acetyl]amino]-N-phenyl-piperidine-1-carboxamide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1NC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O4S/c25-19(14-29-18-8-6-17(7-9-18)24(27)28)21-16-10-12-23(13-11-16)20(26)22-15-4-2-1-3-5-15/h1-9,16H,10-14H2,(H,21,25)(H,22,26)