3-[5-methyl-3-(triphenylmethyl)imidazol-4-yl]propanethioamide

Systemtic Name: 3-[5-methyl-3-(triphenylmethyl)imidazol-4-yl]propanethioamide Openeye Name: 3-(5-methyl-3-trityl-imidazol-4-yl)propanethioamide CAS Name: 3-[5-methyl-3-(triphenylmethyl)-4-imidazolyl]propanethioamide IUPAC Name: 3-(5-methyl-3-tritylimidazol-4-yl)propanethioamide Traditional Name: 3-(5-methyl-3-trityl-imidazol-4-yl)thiopropionamide Formula: C26H25N3S MolecularWeight: 411.5618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)CCC(=S)N

Isomeric SMILES

CC1=C(N(C=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)CCC(=S)N

InChI

InChI=1S/C26H25N3S/c1-20-24(17-18-25(27)30)29(19-28-20)26(21-11-5-2-6-12-21,22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-16,19H,17-18H2,1H3,(H2,27,30)