1-(3-methylphenyl)-3-(3-methyl-6-phenyl-4H-[1,2,3]triazolo[1,5-a][1,4]benzodiazepin-4-yl)urea

Systemtic Name: 1-(3-methylphenyl)-3-(3-methyl-6-phenyl-4H-[1,2,3]triazolo[1,5-a][1,4]benzodiazepin-4-yl)urea Openeye Name: 1-(3-methyl-6-phenyl-4H-triazolo[1,5-a][1,4]benzodiazepin-4-yl)-3-(m-tolyl)urea CAS Name: 1-(3-methylphenyl)-3-(3-methyl-6-phenyl-4H-triazolo[1,5-a][1,4]benzodiazepin-4-yl)urea IUPAC Name: 1-(3-methylphenyl)-3-(3-methyl-6-phenyl-4H-triazolo[1,5-a][1,4]benzodiazepin-4-yl)urea Traditional Name: 1-(3-methyl-6-phenyl-4H-triazolo[1,5-a][1,4]benzodiazepin-4-yl)-3-(m-tolyl)urea Formula: C25H22N6O MolecularWeight: 422.48178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2C3=C(N=NN3C4=CC=CC=C4C(=N2)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2C3=C(N=NN3C4=CC=CC=C4C(=N2)C5=CC=CC=C5)C

InChI

InChI=1S/C25H22N6O/c1-16-9-8-12-19(15-16)26-25(32)28-24-23-17(2)29-30-31(23)21-14-7-6-13-20(21)22(27-24)18-10-4-3-5-11-18/h3-15,24H,1-2H3,(H2,26,28,32)