4-(4-chloranyl-1-phenyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-5-yl)morpholine

Systemtic Name: 4-(4-chloranyl-1-phenyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-5-yl)morpholine Openeye Name: 4-(4-chloro-1-phenyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-5-yl)morpholine CAS Name: 4-(4-chloro-1-phenyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-5-yl)morpholine IUPAC Name: 4-(4-chloro-1-phenyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-5-yl)morpholine Traditional Name: 4-(4-chloro-1-phenyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-5-yl)morpholine Formula: C20H18ClN5O MolecularWeight: 379.84282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=CC=CC=C3N4C(=NN=C4C5=CC=CC=C5)C2Cl

Isomeric SMILES

C1COCCN1C2=NC3=CC=CC=C3N4C(=NN=C4C5=CC=CC=C5)C2Cl

InChI

InChI=1S/C20H18ClN5O/c21-17-19(25-10-12-27-13-11-25)22-15-8-4-5-9-16(15)26-18(23-24-20(17)26)14-6-2-1-3-7-14/h1-9,17H,10-13H2