ethyl 2-[methyl-[(3-phenethyl-2-propan-2-ylsulfonyl-imidazol-4-yl)methyl]amino]ethanoate

Systemtic Name: ethyl 2-[methyl-[(3-phenethyl-2-propan-2-ylsulfonyl-imidazol-4-yl)methyl]amino]ethanoate Openeye Name: ethyl 2-[(2-isopropylsulfonyl-3-phenethyl-imidazol-4-yl)methyl-methyl-amino]acetate CAS Name: 2-[methyl-[(3-phenethyl-2-propan-2-ylsulfonyl-4-imidazolyl)methyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[methyl-[(3-phenethyl-2-propan-2-ylsulfonylimidazol-4-yl)methyl]amino]acetate Traditional Name: 2-[(2-isopropylsulfonyl-3-phenethyl-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(N1CCC2=CC=CC=C2)S(=O)(=O)C(C)C

Isomeric SMILES

CCOC(=O)CN(C)CC1=CN=C(N1CCC2=CC=CC=C2)S(=O)(=O)C(C)C

InChI

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