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

Systemtic Name: (4R)-5-[2-(1-ethylbenzimidazol-2-yl)sulfanylethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: (4R)-5-[2-(1-ethylbenzimidazol-2-yl)sulfanylacetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: (4R)-5-[2-[(1-ethyl-2-benzimidazolyl)thio]-1-oxoethyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: (4R)-5-[2-(1-ethylbenzimidazol-2-yl)sulfanylacetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: (4R)-5-[2-[(1-ethylbenzimidazol-2-yl)thio]acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SCC(=O)N3C(CC(=O)NC4=CC=CC=C43)C

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SCC(=O)N3[C@@H](CC(=O)NC4=CC=CC=C43)C

InChI

InChI=1S/C21H22N4O2S/c1-3-24-17-10-6-4-8-15(17)23-21(24)28-13-20(27)25-14(2)12-19(26)22-16-9-5-7-11-18(16)25/h4-11,14H,3,12-13H2,1-2H3,(H,22,26)/t14-/m1/s1