N-(2-chloranyl-4-methyl-phenyl)-4-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]piperidine-1-carbothioamide

Systemtic Name: N-(2-chloranyl-4-methyl-phenyl)-4-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]piperidine-1-carbothioamide Openeye Name: N-(2-chloro-4-methyl-phenyl)-4-[4-(2-nitrophenyl)thiazol-2-yl]piperidine-1-carbothioamide CAS Name: N-(2-chloro-4-methylphenyl)-4-[4-(2-nitrophenyl)-2-thiazolyl]-1-piperidinecarbothioamide IUPAC Name: N-(2-chloro-4-methylphenyl)-4-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]piperidine-1-carbothioamide Traditional Name: N-(2-chloro-4-methyl-phenyl)-4-[4-(2-nitrophenyl)thiazol-2-yl]piperidine-1-carbothioamide Formula: C22H21ClN4O2S2 MolecularWeight: 473.01074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)N2CCC(CC2)C3=NC(=CS3)C4=CC=CC=C4[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N2CCC(CC2)C3=NC(=CS3)C4=CC=CC=C4[N+](=O)[O-])Cl

InChI

InChI=1S/C22H21ClN4O2S2/c1-14-6-7-18(17(23)12-14)25-22(30)26-10-8-15(9-11-26)21-24-19(13-31-21)16-4-2-3-5-20(16)27(28)29/h2-7,12-13,15H,8-11H2,1H3,(H,25,30)