3-(1H-indol-2-ylmethyl)-5-thiophen-2-yl-1,3-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 3-(1H-indol-2-ylmethyl)-5-thiophen-2-yl-1,3-dihydro-1,4-benzodiazepin-2-one Openeye Name: 3-(1H-indol-2-ylmethyl)-5-(2-thienyl)-1,3-dihydro-1,4-benzodiazepin-2-one CAS Name: 3-(1H-indol-2-ylmethyl)-5-thiophen-2-yl-1,3-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 3-(1H-indol-2-ylmethyl)-5-thiophen-2-yl-1,3-dihydro-1,4-benzodiazepin-2-one Traditional Name: 3-(1H-indol-2-ylmethyl)-5-(2-thienyl)-1,3-dihydro-1,4-benzodiazepin-2-one Formula: C22H17N3OS MolecularWeight: 371.45488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N2)CC3C(=O)NC4=CC=CC=C4C(=N3)C5=CC=CS5

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2)CC3C(=O)NC4=CC=CC=C4C(=N3)C5=CC=CS5

InChI

InChI=1S/C22H17N3OS/c26-22-19(13-15-12-14-6-1-3-8-17(14)23-15)24-21(20-10-5-11-27-20)16-7-2-4-9-18(16)25-22/h1-12,19,23H,13H2,(H,25,26)