1-[1-(dimethylsulfamoylamino)-2-oxidanyl-propan-2-yl]-4-(4-isocyanophenyl)benzene

Systemtic Name: 1-[1-(dimethylsulfamoylamino)-2-oxidanyl-propan-2-yl]-4-(4-isocyanophenyl)benzene Openeye Name: 1-[2-(dimethylsulfamoylamino)-1-hydroxy-1-methyl-ethyl]-4-(4-isocyanophenyl)benzene CAS Name: 1-[1-(dimethylsulfamoylamino)-2-hydroxypropan-2-yl]-4-(4-isocyanophenyl)benzene IUPAC Name: 1-[1-(dimethylsulfamoylamino)-2-hydroxypropan-2-yl]-4-(4-isocyanophenyl)benzene Traditional Name: 1-[2-(dimethylsulfamoylamino)-1-hydroxy-1-methyl-ethyl]-4-(4-isocyanophenyl)benzene Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNS(=O)(=O)N(C)C)(C1=CC=C(C=C1)C2=CC=C(C=C2)[N+]#[C-])O

Isomeric SMILES

CC(CNS(=O)(=O)N(C)C)(C1=CC=C(C=C1)C2=CC=C(C=C2)[N+]#[C-])O

InChI

InChI=1S/C18H21N3O3S/c1-18(22,13-20-25(23,24)21(3)4)16-9-5-14(6-10-16)15-7-11-17(19-2)12-8-15/h5-12,20,22H,13H2,1,3-4H3