N-[4-[(3S)-3-methylpiperidin-1-yl]-3-nitro-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[(3S)-3-methylpiperidin-1-yl]-3-nitro-phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[(3S)-3-methyl-1-piperidyl]-3-nitro-phenyl]thiophene-2-carboxamide CAS Name: N-[4-[(3S)-3-methyl-1-piperidinyl]-3-nitrophenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[(3S)-3-methylpiperidin-1-yl]-3-nitrophenyl]thiophene-2-carboxamide Traditional Name: N-[4-[(3S)-3-methylpiperidino]-3-nitro-phenyl]thiophene-2-carboxamide Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)NC(=O)C3=CC=CS3)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)C2=C(C=C(C=C2)NC(=O)C3=CC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O3S/c1-12-4-2-8-19(11-12)14-7-6-13(10-15(14)20(22)23)18-17(21)16-5-3-9-24-16/h3,5-7,9-10,12H,2,4,8,11H2,1H3,(H,18,21)/t12-/m0/s1