5-[2-(4-bromophenyl)sulfanylethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: 5-[2-(4-bromophenyl)sulfanylethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: 5-[2-(4-bromophenyl)sulfanylacetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: 5-[2-[(4-bromophenyl)thio]-1-oxoethyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: 5-[2-(4-bromophenyl)sulfanylacetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: 5-[2-[(4-bromophenyl)thio]acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C18H17BrN2O2S MolecularWeight: 405.30878

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CSC3=CC=C(C=C3)Br

Isomeric SMILES

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CSC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrN2O2S/c1-12-10-17(22)20-15-4-2-3-5-16(15)21(12)18(23)11-24-14-8-6-13(19)7-9-14/h2-9,12H,10-11H2,1H3,(H,20,22)