[(2S)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl]-[4-(methylsulfonylamino)phenyl]azanide

Systemtic Name: [(2S)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl]-[4-(methylsulfonylamino)phenyl]azanide Openeye Name: [(1S)-2-(1-adamantylamino)-1-methyl-2-oxo-ethyl]-[4-(methanesulfonamido)phenyl]azanide CAS Name: [(2S)-1-(1-adamantylamino)-1-oxopropan-2-yl]-[4-(methanesulfonamido)phenyl]azanide IUPAC Name: [(2S)-1-(1-adamantylamino)-1-oxopropan-2-yl]-[4-(methanesulfonamido)phenyl]azanide Traditional Name: [(1S)-2-(1-adamantylamino)-2-keto-1-methyl-ethyl]-[4-(methanesulfonamido)phenyl]azanide Formula: C20H28N3O3S- MolecularWeight: 390.51962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)[N-]C4=CC=C(C=C4)NS(=O)(=O)C

Isomeric SMILES

C[C@@H](C(=O)NC12CC3CC(C1)CC(C3)C2)[N-]C4=CC=C(C=C4)NS(=O)(=O)C

InChI

InChI=1S/C20H28N3O3S/c1-13(21-17-3-5-18(6-4-17)23-27(2,25)26)19(24)22-20-10-14-7-15(11-20)9-16(8-14)12-20/h3-6,13-16,23H,7-12H2,1-2H3,(H,22,24)/q-1/t13-,14?,15?,16?,20?/m0/s1