N-(3-chloranyl-2-methyl-phenyl)-2-[[4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]amino]ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[[4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]amino]ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[4-[(3-methyl-1-piperidyl)sulfonyl]-2-nitro-anilino]acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[4-[(3-methyl-1-piperidinyl)sulfonyl]-2-nitroanilino]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[4-(3-methylpiperidin-1-yl)sulfonyl-2-nitroanilino]acetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[4-(3-methylpiperidino)sulfonyl-2-nitro-anilino]acetamide Formula: C21H25ClN4O5S MolecularWeight: 480.965

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCC(=O)NC3=C(C(=CC=C3)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCC(=O)NC3=C(C(=CC=C3)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C21H25ClN4O5S/c1-14-5-4-10-25(13-14)32(30,31)16-8-9-19(20(11-16)26(28)29)23-12-21(27)24-18-7-3-6-17(22)15(18)2/h3,6-9,11,14,23H,4-5,10,12-13H2,1-2H3,(H,24,27)