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7,8-dimethoxy-4-methylsulfanyl-2-phenyl-3H-1,5-benzodiazepine

7,8-dimethoxy-4-methylsulfanyl-2-phenyl-3H-1,5-benzodiazepine

Systemtic Name:7,8-dimethoxy-4-methylsulfanyl-2-phenyl-3H-1,5-benzodiazepine
Openeye Name:7,8-dimethoxy-4-methylsulfanyl-2-phenyl-3H-1,5-benzodiazepine
CAS Name:7,8-dimethoxy-4-(methylthio)-2-phenyl-3H-1,5-benzodiazepine
IUPAC Name:7,8-dimethoxy-4-methylsulfanyl-2-phenyl-3H-1,5-benzodiazepine
Traditional Name:7,8-dimethoxy-4-(methylthio)-2-phenyl-3H-1,5-benzodiazepine
Formula: C18H18N2O2S
MolecularWeight: 326.41272
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(CC(=N2)SC)C3=CC=CC=C3)OC


Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(CC(=N2)SC)C3=CC=CC=C3)OC


InChI

InChI=1S/C18H18N2O2S/c1-21-16-9-14-15(10-17(16)22-2)20-18(23-3)11-13(19-14)12-7-5-4-6-8-12/h4-10H,11H2,1-3H3


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