N-methyl-N-[[2-(2-methylpropylsulfonyl)-3-(phenylmethyl)imidazol-4-yl]methyl]-1-thiophen-3-yl-methanamine

Systemtic Name: N-methyl-N-[[2-(2-methylpropylsulfonyl)-3-(phenylmethyl)imidazol-4-yl]methyl]-1-thiophen-3-yl-methanamine Openeye Name: N-[(3-benzyl-2-isobutylsulfonyl-imidazol-4-yl)methyl]-N-methyl-1-(3-thienyl)methanamine CAS Name: N-methyl-N-[[2-(2-methylpropylsulfonyl)-3-(phenylmethyl)-4-imidazolyl]methyl]-1-(3-thiophenyl)methanamine IUPAC Name: N-[[3-benzyl-2-(2-methylpropylsulfonyl)imidazol-4-yl]methyl]-N-methyl-1-thiophen-3-ylmethanamine Traditional Name: (3-benzyl-2-isobutylsulfonyl-imidazol-4-yl)methyl-methyl-(3-thenyl)amine Formula: C21H27N3O2S2 MolecularWeight: 417.58798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CS(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2)CN(C)CC3=CSC=C3

Isomeric SMILES

CC(C)CS(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2)CN(C)CC3=CSC=C3

InChI

InChI=1S/C21H27N3O2S2/c1-17(2)16-28(25,26)21-22-11-20(14-23(3)12-19-9-10-27-15-19)24(21)13-18-7-5-4-6-8-18/h4-11,15,17H,12-14,16H2,1-3H3