5-[[[methylsulfanyl-[(triphenylmethyl)amino]methyl]amino]methyl]-1-(phenylmethyl)imidazole-4-carboxamide

Systemtic Name: 5-[[[methylsulfanyl-[(triphenylmethyl)amino]methyl]amino]methyl]-1-(phenylmethyl)imidazole-4-carboxamide Openeye Name: 1-benzyl-5-[[[methylsulfanyl-(tritylamino)methyl]amino]methyl]imidazole-4-carboxamide CAS Name: 5-[[[(methylthio)-[(triphenylmethyl)amino]methyl]amino]methyl]-1-(phenylmethyl)-4-imidazolecarboxamide IUPAC Name: 1-benzyl-5-[[[methylsulfanyl-(tritylamino)methyl]amino]methyl]imidazole-4-carboxamide Traditional Name: 1-benzyl-5-[[[(methylthio)-(tritylamino)methyl]amino]methyl]imidazole-4-carboxamide Formula: C33H33N5OS MolecularWeight: 547.71302

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Descriptors Computed from Structure

Canonical SMILES:

CSC(NCC1=C(N=CN1CC2=CC=CC=C2)C(=O)N)NC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CSC(NCC1=C(N=CN1CC2=CC=CC=C2)C(=O)N)NC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H33N5OS/c1-40-32(35-22-29-30(31(34)39)36-24-38(29)23-25-14-6-2-7-15-25)37-33(26-16-8-3-9-17-26,27-18-10-4-11-19-27)28-20-12-5-13-21-28/h2-21,24,32,35,37H,22-23H2,1H3,(H2,34,39)