2-[(5-phenyl-3-thiophen-2-yl-3H-1,4-benzodiazepin-2-yl)amino]ethanol

Systemtic Name: 2-[(5-phenyl-3-thiophen-2-yl-3H-1,4-benzodiazepin-2-yl)amino]ethanol Openeye Name: 2-[[5-phenyl-3-(2-thienyl)-3H-1,4-benzodiazepin-2-yl]amino]ethanol CAS Name: 2-[(5-phenyl-3-thiophen-2-yl-3H-1,4-benzodiazepin-2-yl)amino]ethanol IUPAC Name: 2-[(5-phenyl-3-thiophen-2-yl-3H-1,4-benzodiazepin-2-yl)amino]ethanol Traditional Name: 2-[[5-phenyl-3-(2-thienyl)-3H-1,4-benzodiazepin-2-yl]amino]ethanol Formula: C21H19N3OS MolecularWeight: 361.46006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(C(=NC3=CC=CC=C32)NCCO)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(C(=NC3=CC=CC=C32)NCCO)C4=CC=CS4

InChI

InChI=1S/C21H19N3OS/c25-13-12-22-21-20(18-11-6-14-26-18)24-19(15-7-2-1-3-8-15)16-9-4-5-10-17(16)23-21/h1-11,14,20,25H,12-13H2,(H,22,23)