10-hexanoyl-5-methyl-thieno[3,4-b][1,5]benzodiazepin-4-one

Systemtic Name: 10-hexanoyl-5-methyl-thieno[3,4-b][1,5]benzodiazepin-4-one Openeye Name: 10-hexanoyl-5-methyl-thieno[3,4-b][1,5]benzodiazepin-4-one CAS Name: 5-methyl-10-(1-oxohexyl)-4-thieno[3,4-b][1,5]benzodiazepinone IUPAC Name: 10-hexanoyl-5-methylthieno[3,4-b][1,5]benzodiazepin-4-one Traditional Name: 10-caproyl-5-methyl-thieno[3,4-b][1,5]benzodiazepin-4-one Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1C2=CC=CC=C2N(C(=O)C3=CSC=C31)C

Isomeric SMILES

CCCCCC(=O)N1C2=CC=CC=C2N(C(=O)C3=CSC=C31)C

InChI

InChI=1S/C18H20N2O2S/c1-3-4-5-10-17(21)20-15-9-7-6-8-14(15)19(2)18(22)13-11-23-12-16(13)20/h6-9,11-12H,3-5,10H2,1-2H3