1-[6-(2-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-yl]-3-(2-hydroxyethyl)urea

Systemtic Name: 1-[6-(2-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-yl]-3-(2-hydroxyethyl)urea Openeye Name: 1-[6-(2-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-yl]-3-(2-hydroxyethyl)urea CAS Name: 1-[6-(2-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-yl]-3-(2-hydroxyethyl)urea IUPAC Name: 1-[6-(2-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-yl]-3-(2-hydroxyethyl)urea Traditional Name: 1-[6-(2-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-yl]-3-(2-hydroxyethyl)urea Formula: C19H17ClN6O2 MolecularWeight: 396.83028

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=NN=CN2C3=C(C=C(C=C3)NC(=O)NCCO)C(=N1)C4=CC=CC=C4Cl

Isomeric SMILES

C1C2=NN=CN2C3=C(C=C(C=C3)NC(=O)NCCO)C(=N1)C4=CC=CC=C4Cl

InChI

InChI=1S/C19H17ClN6O2/c20-15-4-2-1-3-13(15)18-14-9-12(24-19(28)21-7-8-27)5-6-16(14)26-11-23-25-17(26)10-22-18/h1-6,9,11,27H,7-8,10H2,(H2,21,24,28)