4-[2,6-bis(fluoranyl)phenyl]carbonyl-7-bromanyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 4-[2,6-bis(fluoranyl)phenyl]carbonyl-7-bromanyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-4-(2,6-difluorobenzoyl)-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-4-[(2,6-difluorophenyl)-oxomethyl]-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-4-(2,6-difluorobenzoyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-4-(2,6-difluorobenzoyl)-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C20H13BrF2N2O2S MolecularWeight: 463.295226

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(C=C(C=C2)Br)C(N1C(=O)C3=C(C=CC=C3F)F)C4=CC=CS4

Isomeric SMILES

C1C(=O)NC2=C(C=C(C=C2)Br)C(N1C(=O)C3=C(C=CC=C3F)F)C4=CC=CS4

InChI

InChI=1S/C20H13BrF2N2O2S/c21-11-6-7-15-12(9-11)19(16-5-2-8-28-16)25(10-17(26)24-15)20(27)18-13(22)3-1-4-14(18)23/h1-9,19H,10H2,(H,24,26)