2-[4-methyl-2-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]sulfanyl-1,3-thiazol-5-yl]ethanamide

Systemtic Name: 2-[4-methyl-2-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]sulfanyl-1,3-thiazol-5-yl]ethanamide Openeye Name: 2-[4-methyl-2-[4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-phenyl]sulfanyl-thiazol-5-yl]acetamide CAS Name: 2-[4-methyl-2-[[4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitrophenyl]thio]-5-thiazolyl]acetamide IUPAC Name: 2-[4-methyl-2-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitrophenyl]sulfanyl-1,3-thiazol-5-yl]acetamide Traditional Name: 2-[4-methyl-2-[[4-(4-methylpiperidino)sulfonyl-2-nitro-phenyl]thio]thiazol-5-yl]acetamide Formula: C18H22N4O5S3 MolecularWeight: 470.58608

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)SC3=NC(=C(S3)CC(=O)N)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)SC3=NC(=C(S3)CC(=O)N)C)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O5S3/c1-11-5-7-21(8-6-11)30(26,27)13-3-4-15(14(9-13)22(24)25)28-18-20-12(2)16(29-18)10-17(19)23/h3-4,9,11H,5-8,10H2,1-2H3,(H2,19,23)