7-bromanyl-4-(2,2-diphenylethanoyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 7-bromanyl-4-(2,2-diphenylethanoyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-4-(2,2-diphenylacetyl)-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-4-(1-oxo-2,2-diphenylethyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-4-(2,2-diphenylacetyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-4-(2,2-diphenylacetyl)-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C27H21BrN2O2S MolecularWeight: 517.43684

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(C=C(C=C2)Br)C(N1C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

C1C(=O)NC2=C(C=C(C=C2)Br)C(N1C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C27H21BrN2O2S/c28-20-13-14-22-21(16-20)26(23-12-7-15-33-23)30(17-24(31)29-22)27(32)25(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-16,25-26H,17H2,(H,29,31)