N-(2-methyl-1,3-benzothiazol-6-yl)-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-(2-nitrophenyl)isonipecotamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3S/c1-13-21-16-7-6-15(12-19(16)28-13)22-20(25)14-8-10-23(11-9-14)17-4-2-3-5-18(17)24(26)27/h2-7,12,14H,8-11H2,1H3,(H,22,25)