3-[[1-(4-chlorophenyl)carbonylindol-3-yl]methyl]-5-(2-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 3-[[1-(4-chlorophenyl)carbonylindol-3-yl]methyl]-5-(2-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one Openeye Name: 3-[[1-(4-chlorobenzoyl)indol-3-yl]methyl]-5-(2-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one CAS Name: 3-[[1-[(4-chlorophenyl)-oxomethyl]-3-indolyl]methyl]-5-(2-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-[[1-(4-chlorobenzoyl)indol-3-yl]methyl]-5-(2-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one Traditional Name: 3-[[1-(4-chlorobenzoyl)indol-3-yl]methyl]-5-(2-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one Formula: C32H23ClFN3O2 MolecularWeight: 535.995323

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)CC3=CN(C4=CC=CC=C43)C(=O)C5=CC=C(C=C5)Cl)C6=CC=CC=C6F

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC(C1=O)CC3=CN(C4=CC=CC=C43)C(=O)C5=CC=C(C=C5)Cl)C6=CC=CC=C6F

InChI

InChI=1S/C32H23ClFN3O2/c1-36-28-12-6-4-10-25(28)30(24-9-2-5-11-26(24)34)35-27(32(36)39)18-21-19-37(29-13-7-3-8-23(21)29)31(38)20-14-16-22(33)17-15-20/h2-17,19,27H,18H2,1H3