(3E)-5-methyl-3-(sulfanylmethylidene)-4H-1,4-benzodiazepin-2-one

Systemtic Name: (3E)-5-methyl-3-(sulfanylmethylidene)-4H-1,4-benzodiazepin-2-one Openeye Name: (3E)-5-methyl-3-(sulfanylmethylene)-4H-1,4-benzodiazepin-2-one CAS Name: (3E)-3-(mercaptomethylidene)-5-methyl-4H-1,4-benzodiazepin-2-one IUPAC Name: (3E)-5-methyl-3-(sulfanylmethylidene)-4H-1,4-benzodiazepin-2-one Traditional Name: (3E)-3-(mercaptomethylene)-5-methyl-4H-1,4-benzodiazepin-2-one Formula: C11H10N2OS MolecularWeight: 218.2749

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=CC2=NC(=O)C(=CS)N1

Isomeric SMILES

CC1=C2C=CC=CC2=NC(=O)/C(=C\S)/N1

InChI

InChI=1S/C11H10N2OS/c1-7-8-4-2-3-5-9(8)13-11(14)10(6-15)12-7/h2-6,12,15H,1H3/b10-6+