10-(4-bromanylbutanoyl)-1-chloranyl-3-methyl-5H-thieno[3,4-b][1,5]benzodiazepin-4-one

Systemtic Name: 10-(4-bromanylbutanoyl)-1-chloranyl-3-methyl-5H-thieno[3,4-b][1,5]benzodiazepin-4-one Openeye Name: 10-(4-bromobutanoyl)-1-chloro-3-methyl-5H-thieno[3,4-b][1,5]benzodiazepin-4-one CAS Name: 10-(4-bromo-1-oxobutyl)-1-chloro-3-methyl-5H-thieno[3,4-b][1,5]benzodiazepin-4-one IUPAC Name: 10-(4-bromobutanoyl)-1-chloro-3-methyl-5H-thieno[3,4-b][1,5]benzodiazepin-4-one Traditional Name: 10-(4-bromobutanoyl)-1-chloro-3-methyl-5H-thieno[3,4-b][1,5]benzodiazepin-4-one Formula: C16H14BrClN2O2S MolecularWeight: 413.71656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(S1)Cl)N(C3=CC=CC=C3NC2=O)C(=O)CCCBr

Isomeric SMILES

CC1=C2C(=C(S1)Cl)N(C3=CC=CC=C3NC2=O)C(=O)CCCBr

InChI

InChI=1S/C16H14BrClN2O2S/c1-9-13-14(15(18)23-9)20(12(21)7-4-8-17)11-6-3-2-5-10(11)19-16(13)22/h2-3,5-6H,4,7-8H2,1H3,(H,19,22)