3-azanyl-1-[[1-(triphenylmethyl)imidazol-4-yl]methyl]-5H-1,4-benzodiazepin-2-one

Systemtic Name: 3-azanyl-1-[[1-(triphenylmethyl)imidazol-4-yl]methyl]-5H-1,4-benzodiazepin-2-one Openeye Name: 3-amino-1-[(1-tritylimidazol-4-yl)methyl]-5H-1,4-benzodiazepin-2-one CAS Name: 3-amino-1-[[1-(triphenylmethyl)-4-imidazolyl]methyl]-5H-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-1-[(1-tritylimidazol-4-yl)methyl]-5H-1,4-benzodiazepin-2-one Traditional Name: 3-amino-1-[(1-tritylimidazol-4-yl)methyl]-5H-1,4-benzodiazepin-2-one Formula: C32H27N5O MolecularWeight: 497.58968

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2N(C(=O)C(=N1)N)CC3=CN(C=N3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1C2=CC=CC=C2N(C(=O)C(=N1)N)CC3=CN(C=N3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C32H27N5O/c33-30-31(38)37(29-19-11-10-12-24(29)20-34-30)22-28-21-36(23-35-28)32(25-13-4-1-5-14-25,26-15-6-2-7-16-26)27-17-8-3-9-18-27/h1-19,21,23H,20,22H2,(H2,33,34)