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

Systemtic Name: 5-(2-fluorophenyl)-1-methyl-3-[(1-methylindol-3-yl)methyl]-3H-1,4-benzodiazepin-2-one Openeye Name: 5-(2-fluorophenyl)-1-methyl-3-[(1-methylindol-3-yl)methyl]-3H-1,4-benzodiazepin-2-one CAS Name: 5-(2-fluorophenyl)-1-methyl-3-[(1-methyl-3-indolyl)methyl]-3H-1,4-benzodiazepin-2-one IUPAC Name: 5-(2-fluorophenyl)-1-methyl-3-[(1-methylindol-3-yl)methyl]-3H-1,4-benzodiazepin-2-one Traditional Name: 5-(2-fluorophenyl)-1-methyl-3-[(1-methylindol-3-yl)methyl]-3H-1,4-benzodiazepin-2-one Formula: C26H22FN3O MolecularWeight: 411.470783

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)CC3C(=O)N(C4=CC=CC=C4C(=N3)C5=CC=CC=C5F)C

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)CC3C(=O)N(C4=CC=CC=C4C(=N3)C5=CC=CC=C5F)C

InChI

InChI=1S/C26H22FN3O/c1-29-16-17(18-9-4-7-13-23(18)29)15-22-26(31)30(2)24-14-8-5-11-20(24)25(28-22)19-10-3-6-12-21(19)27/h3-14,16,22H,15H2,1-2H3