4-(4-bromophenyl)carbonyl-7-chloranyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 4-(4-bromophenyl)carbonyl-7-chloranyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 4-(4-bromobenzoyl)-7-chloro-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 4-[(4-bromophenyl)-oxomethyl]-7-chloro-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 4-(4-bromobenzoyl)-7-chloro-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 4-(4-bromobenzoyl)-7-chloro-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C20H14BrClN2O2S MolecularWeight: 461.75936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14BrClN2O2S/c21-13-5-3-12(4-6-13)20(26)24-11-18(25)23-16-8-7-14(22)10-15(16)19(24)17-2-1-9-27-17/h1-10,19H,11H2,(H,23,25)