8-chloranyl-4-methylsulfanyl-1-phenyl-3H-1,5-benzodiazepin-2-one

Systemtic Name: 8-chloranyl-4-methylsulfanyl-1-phenyl-3H-1,5-benzodiazepin-2-one Openeye Name: 8-chloro-4-methylsulfanyl-1-phenyl-3H-1,5-benzodiazepin-2-one CAS Name: 8-chloro-4-(methylthio)-1-phenyl-3H-1,5-benzodiazepin-2-one IUPAC Name: 8-chloro-4-methylsulfanyl-1-phenyl-3H-1,5-benzodiazepin-2-one Traditional Name: 8-chloro-4-(methylthio)-1-phenyl-3H-1,5-benzodiazepin-2-one Formula: C16H13ClN2OS MolecularWeight: 316.80522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C=C(C=C2)Cl)N(C(=O)C1)C3=CC=CC=C3

Isomeric SMILES

CSC1=NC2=C(C=C(C=C2)Cl)N(C(=O)C1)C3=CC=CC=C3

InChI

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