2-chloranyl-N-[4-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[4-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[4-[(3,5-dimethyl-1-piperidyl)methyl]thiazol-2-yl]-4-nitro-benzamide CAS Name: 2-chloro-N-[4-[(3,5-dimethyl-1-piperidinyl)methyl]-2-thiazolyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[4-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[4-[(3,5-dimethylpiperidino)methyl]thiazol-2-yl]-4-nitro-benzamide Formula: C18H21ClN4O3S MolecularWeight: 408.90234

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)CC2=CSC(=N2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1CC(CN(C1)CC2=CSC(=N2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C18H21ClN4O3S/c1-11-5-12(2)8-22(7-11)9-13-10-27-18(20-13)21-17(24)15-4-3-14(23(25)26)6-16(15)19/h3-4,6,10-12H,5,7-9H2,1-2H3,(H,20,21,24)