7-bromanyl-4-[2-(4-chloranylphenoxy)ethanoyl]-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 7-bromanyl-4-[2-(4-chloranylphenoxy)ethanoyl]-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-4-[2-(4-chlorophenoxy)acetyl]-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-4-[2-(4-chlorophenoxy)-1-oxoethyl]-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-4-[2-(4-chlorophenoxy)acetyl]-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-4-[2-(4-chlorophenoxy)acetyl]-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C21H16BrClN2O3S MolecularWeight: 491.78534

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(C=C(C=C2)Br)C(N1C(=O)COC3=CC=C(C=C3)Cl)C4=CC=CS4

Isomeric SMILES

C1C(=O)NC2=C(C=C(C=C2)Br)C(N1C(=O)COC3=CC=C(C=C3)Cl)C4=CC=CS4

InChI

InChI=1S/C21H16BrClN2O3S/c22-13-3-8-17-16(10-13)21(18-2-1-9-29-18)25(11-19(26)24-17)20(27)12-28-15-6-4-14(23)5-7-15/h1-10,21H,11-12H2,(H,24,26)