5-[2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanylethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: 5-[2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanylethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: 5-[2-(5-chloro-1-propyl-benzimidazol-2-yl)sulfanylacetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: 5-[2-[(5-chloro-1-propyl-2-benzimidazolyl)thio]-1-oxoethyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: 5-[2-(5-chloro-1-propylbenzimidazol-2-yl)sulfanylacetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: 5-[2-[(5-chloro-1-propyl-benzimidazol-2-yl)thio]acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C22H23ClN4O2S MolecularWeight: 442.96162

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N3C(CC(=O)NC4=CC=CC=C43)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N3C(CC(=O)NC4=CC=CC=C43)C

InChI

InChI=1S/C22H23ClN4O2S/c1-3-10-26-18-9-8-15(23)12-17(18)25-22(26)30-13-21(29)27-14(2)11-20(28)24-16-6-4-5-7-19(16)27/h4-9,12,14H,3,10-11,13H2,1-2H3,(H,24,28)