1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-4-(2-methylpiperidin-1-yl)sulfonyl-1,4-diazepane

Systemtic Name: 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-4-(2-methylpiperidin-1-yl)sulfonyl-1,4-diazepane Openeye Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-4-[(2-methyl-1-piperidyl)sulfonyl]-1,4-diazepane CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-[(2-methyl-1-piperidinyl)sulfonyl]-1,4-diazepane IUPAC Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-(2-methylpiperidin-1-yl)sulfonyl-1,4-diazepane Traditional Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-4-(2-methylpiperidino)sulfonyl-1,4-diazepane Formula: C17H24ClF3N4O2S MolecularWeight: 440.91127

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)N2CCCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

CC1CCCCN1S(=O)(=O)N2CCCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C17H24ClF3N4O2S/c1-13-5-2-3-8-25(13)28(26,27)24-7-4-6-23(9-10-24)16-15(18)11-14(12-22-16)17(19,20)21/h11-13H,2-10H2,1H3