1-methyl-8-methylsulfonyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-5-one

Systemtic Name: 1-methyl-8-methylsulfonyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-5-one Openeye Name: 1-methyl-8-methylsulfonyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-5-one CAS Name: 1-methyl-8-methylsulfonyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-5-one IUPAC Name: 1-methyl-8-methylsulfonyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-5-one Traditional Name: 8-mesyl-1-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-5-one Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C2N1C3=C(C=C(C=C3)S(=O)(=O)C)N(C(=O)C2)C4=CC=CC=C4

Isomeric SMILES

CC1=NN=C2N1C3=C(C=C(C=C3)S(=O)(=O)C)N(C(=O)C2)C4=CC=CC=C4

InChI

InChI=1S/C18H16N4O3S/c1-12-19-20-17-11-18(23)22(13-6-4-3-5-7-13)16-10-14(26(2,24)25)8-9-15(16)21(12)17/h3-10H,11H2,1-2H3