3-isothiocyanato-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one

Systemtic Name: 3-isothiocyanato-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Openeye Name: 3-isothiocyanato-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one CAS Name: 3-isothiocyanato-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one IUPAC Name: 3-isothiocyanato-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Traditional Name: 3-isothiocyanato-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Formula: C13H10N4OS MolecularWeight: 270.3097

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(N=CN2C3=CC=CC=C3C1=O)N=C=S

Isomeric SMILES

CN1CC2=C(N=CN2C3=CC=CC=C3C1=O)N=C=S

InChI

InChI=1S/C13H10N4OS/c1-16-6-11-12(15-8-19)14-7-17(11)10-5-3-2-4-9(10)13(16)18/h2-5,7H,6H2,1H3