3-ethyl-2-oxidanylidene-N-[[1-(phenylmethyl)pyrrolidin-3-yl]methyl]-1,3-benzoxazole-6-sulfonamide

Systemtic Name: 3-ethyl-2-oxidanylidene-N-[[1-(phenylmethyl)pyrrolidin-3-yl]methyl]-1,3-benzoxazole-6-sulfonamide Openeye Name: N-[(1-benzylpyrrolidin-3-yl)methyl]-3-ethyl-2-oxo-1,3-benzoxazole-6-sulfonamide CAS Name: 3-ethyl-2-oxo-N-[[1-(phenylmethyl)-3-pyrrolidinyl]methyl]-1,3-benzoxazole-6-sulfonamide IUPAC Name: N-[(1-benzylpyrrolidin-3-yl)methyl]-3-ethyl-2-oxo-1,3-benzoxazole-6-sulfonamide Traditional Name: N-[(1-benzylpyrrolidin-3-yl)methyl]-3-ethyl-2-keto-1,3-benzoxazole-6-sulfonamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)NCC3CCN(C3)CC4=CC=CC=C4)OC1=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)NCC3CCN(C3)CC4=CC=CC=C4)OC1=O

InChI

InChI=1S/C21H25N3O4S/c1-2-24-19-9-8-18(12-20(19)28-21(24)25)29(26,27)22-13-17-10-11-23(15-17)14-16-6-4-3-5-7-16/h3-9,12,17,22H,2,10-11,13-15H2,1H3