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

Systemtic Name: 3-azanyl-5-phenyl-1-[[1-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]-3H-1,4-benzodiazepin-2-one Openeye Name: 3-amino-5-phenyl-1-[(1-trityltetrazol-5-yl)methyl]-3H-1,4-benzodiazepin-2-one CAS Name: 3-amino-5-phenyl-1-[[1-(triphenylmethyl)-5-tetrazolyl]methyl]-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-5-phenyl-1-[(1-trityltetrazol-5-yl)methyl]-3H-1,4-benzodiazepin-2-one Traditional Name: 3-amino-5-phenyl-1-[(1-trityltetrazol-5-yl)methyl]-3H-1,4-benzodiazepin-2-one Formula: C36H29N7O MolecularWeight: 575.66176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(C(=O)N(C3=CC=CC=C32)CC4=NN=NN4C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(C(=O)N(C3=CC=CC=C32)CC4=NN=NN4C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)N

InChI

InChI=1S/C36H29N7O/c37-34-35(44)42(31-24-14-13-23-30(31)33(38-34)26-15-5-1-6-16-26)25-32-39-40-41-43(32)36(27-17-7-2-8-18-27,28-19-9-3-10-20-28)29-21-11-4-12-22-29/h1-24,34H,25,37H2