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

Systemtic Name: 4-[2,5-bis(chloranyl)phenyl]carbonyl-7-bromanyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-4-(2,5-dichlorobenzoyl)-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-4-[(2,5-dichlorophenyl)-oxomethyl]-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-4-(2,5-dichlorobenzoyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-4-(2,5-dichlorobenzoyl)-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C20H13BrCl2N2O2S MolecularWeight: 496.20442

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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(=C3)Cl)Cl)C4=CC=CS4

Isomeric SMILES

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

InChI

InChI=1S/C20H13BrCl2N2O2S/c21-11-3-6-16-14(8-11)19(17-2-1-7-28-17)25(10-18(26)24-16)20(27)13-9-12(22)4-5-15(13)23/h1-9,19H,10H2,(H,24,26)