1-(2-dimethylaminoethyl)-3-ethyl-1-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]urea

Systemtic Name: 1-(2-dimethylaminoethyl)-3-ethyl-1-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]urea Openeye Name: 1-[(2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl]-1-(2-dimethylaminoethyl)-3-ethyl-urea CAS Name: 1-(2-dimethylaminoethyl)-3-ethyl-1-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-4-imidazolyl]methyl]urea IUPAC Name: 1-[[2-benzylsulfonyl-3-(2-methylpropyl)imidazol-4-yl]methyl]-1-(2-dimethylaminoethyl)-3-ethylurea Traditional Name: 1-[(2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl]-1-(2-dimethylaminoethyl)-3-ethyl-urea Formula: C22H35N5O3S MolecularWeight: 449.61

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N(CCN(C)C)CC1=CN=C(N1CC(C)C)S(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CCNC(=O)N(CCN(C)C)CC1=CN=C(N1CC(C)C)S(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C22H35N5O3S/c1-6-23-21(28)26(13-12-25(4)5)16-20-14-24-22(27(20)15-18(2)3)31(29,30)17-19-10-8-7-9-11-19/h7-11,14,18H,6,12-13,15-17H2,1-5H3,(H,23,28)