6-chloranyl-N-(cyclohexylmethyl)-N-[(3R)-2-oxidanylideneazepan-3-yl]pyridine-3-sulfonamide

Systemtic Name: 6-chloranyl-N-(cyclohexylmethyl)-N-[(3R)-2-oxidanylideneazepan-3-yl]pyridine-3-sulfonamide Openeye Name: 6-chloro-N-(cyclohexylmethyl)-N-[(3R)-2-oxoazepan-3-yl]pyridine-3-sulfonamide CAS Name: 6-chloro-N-(cyclohexylmethyl)-N-[(3R)-2-oxo-3-azepanyl]-3-pyridinesulfonamide IUPAC Name: 6-chloro-N-(cyclohexylmethyl)-N-[(3R)-2-oxoazepan-3-yl]pyridine-3-sulfonamide Traditional Name: 6-chloro-N-(cyclohexylmethyl)-N-[(3R)-2-ketoazepan-3-yl]pyridine-3-sulfonamide Formula: C18H26ClN3O3S MolecularWeight: 399.93534

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN(C2CCCCNC2=O)S(=O)(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

C1CCC(CC1)CN([C@@H]2CCCCNC2=O)S(=O)(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C18H26ClN3O3S/c19-17-10-9-15(12-21-17)26(24,25)22(13-14-6-2-1-3-7-14)16-8-4-5-11-20-18(16)23/h9-10,12,14,16H,1-8,11,13H2,(H,20,23)/t16-/m1/s1