ethyl 2-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl-methyl-amino]ethanoate

Systemtic Name: ethyl 2-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl-methyl-amino]ethanoate Openeye Name: ethyl 2-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl-methyl-amino]acetate CAS Name: 2-[[2-ethylsulfonyl-3-(3-phenylpropyl)-4-imidazolyl]methyl-methylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl-methylamino]acetate Traditional Name: 2-[[2-esyl-3-(3-phenylpropyl)imidazol-4-yl]methyl-methyl-amino]acetic acid ethyl ester Formula: C20H29N3O4S MolecularWeight: 407.52696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C)CC1=CN=C(N1CCCC2=CC=CC=C2)S(=O)(=O)CC

Isomeric SMILES

CCOC(=O)CN(C)CC1=CN=C(N1CCCC2=CC=CC=C2)S(=O)(=O)CC

InChI

InChI=1S/C20H29N3O4S/c1-4-27-19(24)16-22(3)15-18-14-21-20(28(25,26)5-2)23(18)13-9-12-17-10-7-6-8-11-17/h6-8,10-11,14H,4-5,9,12-13,15-16H2,1-3H3