1-(furan-2-yl)-N-methyl-N-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]methanamine

Systemtic Name: 1-(furan-2-yl)-N-methyl-N-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]methanamine Openeye Name: N-[(2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl]-1-(2-furyl)-N-methyl-methanamine CAS Name: 1-(2-furanyl)-N-methyl-N-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-4-imidazolyl]methyl]methanamine IUPAC Name: N-[[2-benzylsulfonyl-3-(2-methylpropyl)imidazol-4-yl]methyl]-1-(furan-2-yl)-N-methylmethanamine Traditional Name: (2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl-(2-furfuryl)-methyl-amine Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1S(=O)(=O)CC2=CC=CC=C2)CN(C)CC3=CC=CO3

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)CC2=CC=CC=C2)CN(C)CC3=CC=CO3

InChI

InChI=1S/C21H27N3O3S/c1-17(2)13-24-19(14-23(3)15-20-10-7-11-27-20)12-22-21(24)28(25,26)16-18-8-5-4-6-9-18/h4-12,17H,13-16H2,1-3H3