2,3-dihydroindol-1-yl-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-2,3,4,5-tetrahydro-1,4-benzodiazepin-2-yl]methanone

Systemtic Name: 2,3-dihydroindol-1-yl-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-2,3,4,5-tetrahydro-1,4-benzodiazepin-2-yl]methanone Openeye Name: [1-(1H-imidazol-5-ylmethyl)-7-phenyl-2,3,4,5-tetrahydro-1,4-benzodiazepin-2-yl]-indolin-1-yl-methanone CAS Name: 2,3-dihydroindol-1-yl-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-2,3,4,5-tetrahydro-1,4-benzodiazepin-2-yl]methanone IUPAC Name: 2,3-dihydroindol-1-yl-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-2,3,4,5-tetrahydro-1,4-benzodiazepin-2-yl]methanone Traditional Name: [1-(1H-imidazol-5-ylmethyl)-7-phenyl-2,3,4,5-tetrahydro-1,4-benzodiazepin-2-yl]-indolin-1-yl-methanone Formula: C28H27N5O MolecularWeight: 449.54688

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C(=O)C3CNCC4=C(N3CC5=CN=CN5)C=CC(=C4)C6=CC=CC=C6

Isomeric SMILES

C1CN(C2=CC=CC=C21)C(=O)C3CNCC4=C(N3CC5=CN=CN5)C=CC(=C4)C6=CC=CC=C6

InChI

InChI=1S/C28H27N5O/c34-28(32-13-12-21-8-4-5-9-25(21)32)27-17-29-15-23-14-22(20-6-2-1-3-7-20)10-11-26(23)33(27)18-24-16-30-19-31-24/h1-11,14,16,19,27,29H,12-13,15,17-18H2,(H,30,31)