tert-butyl 2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]ethanoate

Systemtic Name: tert-butyl 2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]ethanoate Openeye Name: tert-butyl 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetate CAS Name: 2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetate Traditional Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)thio]acetic acid tert-butyl ester Formula: C17H22N2O2S MolecularWeight: 318.43378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)SCC(=O)OC(C)(C)C)CC2=CC=CC=C2

Isomeric SMILES

CC1=C(N=C(N1)SCC(=O)OC(C)(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C17H22N2O2S/c1-12-14(10-13-8-6-5-7-9-13)19-16(18-12)22-11-15(20)21-17(2,3)4/h5-9H,10-11H2,1-4H3,(H,18,19)