4-(4-methoxyphenyl)-7-(2-methylphenoxy)-1,3-dihydro-1,5-benzodiazepine-2-thione

Systemtic Name: 4-(4-methoxyphenyl)-7-(2-methylphenoxy)-1,3-dihydro-1,5-benzodiazepine-2-thione Openeye Name: 4-(4-methoxyphenyl)-7-(2-methylphenoxy)-1,3-dihydro-1,5-benzodiazepine-2-thione CAS Name: 4-(4-methoxyphenyl)-7-(2-methylphenoxy)-1,3-dihydro-1,5-benzodiazepine-2-thione IUPAC Name: 4-(4-methoxyphenyl)-7-(2-methylphenoxy)-1,3-dihydro-1,5-benzodiazepine-2-thione Traditional Name: 4-(4-methoxyphenyl)-7-(2-methylphenoxy)-1,3-dihydro-1,5-benzodiazepine-2-thione Formula: C23H20N2O2S MolecularWeight: 388.4821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC3=C(C=C2)NC(=S)CC(=N3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=CC=C1OC2=CC3=C(C=C2)NC(=S)CC(=N3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H20N2O2S/c1-15-5-3-4-6-22(15)27-18-11-12-19-21(13-18)24-20(14-23(28)25-19)16-7-9-17(26-2)10-8-16/h3-13H,14H2,1-2H3,(H,25,28)