7-chloranyl-5-(2-methylsulfanylphenyl)-1,3-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-5-(2-methylsulfanylphenyl)-1,3-dihydro-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-5-(2-methylsulfanylphenyl)-1,3-dihydro-1,4-benzodiazepin-2-one CAS Name: 7-chloro-5-[2-(methylthio)phenyl]-1,3-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-5-(2-methylsulfanylphenyl)-1,3-dihydro-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-5-[2-(methylthio)phenyl]-1,3-dihydro-1,4-benzodiazepin-2-one Formula: C16H13ClN2OS MolecularWeight: 316.80522

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C2=NCC(=O)NC3=C2C=C(C=C3)Cl

Isomeric SMILES

CSC1=CC=CC=C1C2=NCC(=O)NC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN2OS/c1-21-14-5-3-2-4-11(14)16-12-8-10(17)6-7-13(12)19-15(20)9-18-16/h2-8H,9H2,1H3,(H,19,20)