4-(4-chloranyl-3-nitro-phenyl)-2-[1-[(5-methylsulfanylthiophen-2-yl)methyl]piperidin-4-yl]-1,3-thiazole

Systemtic Name: 4-(4-chloranyl-3-nitro-phenyl)-2-[1-[(5-methylsulfanylthiophen-2-yl)methyl]piperidin-4-yl]-1,3-thiazole Openeye Name: 4-(4-chloro-3-nitro-phenyl)-2-[1-[(5-methylsulfanyl-2-thienyl)methyl]-4-piperidyl]thiazole CAS Name: 4-(4-chloro-3-nitrophenyl)-2-[1-[[5-(methylthio)-2-thiophenyl]methyl]-4-piperidinyl]thiazole IUPAC Name: 4-(4-chloro-3-nitrophenyl)-2-[1-[(5-methylsulfanylthiophen-2-yl)methyl]piperidin-4-yl]-1,3-thiazole Traditional Name: 4-(4-chloro-3-nitro-phenyl)-2-[1-[[5-(methylthio)-2-thienyl]methyl]-4-piperidyl]thiazole Formula: C20H20ClN3O2S3 MolecularWeight: 466.0397

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(S1)CN2CCC(CC2)C3=NC(=CS3)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(S1)CN2CCC(CC2)C3=NC(=CS3)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H20ClN3O2S3/c1-27-19-5-3-15(29-19)11-23-8-6-13(7-9-23)20-22-17(12-28-20)14-2-4-16(21)18(10-14)24(25)26/h2-5,10,12-13H,6-9,11H2,1H3