7-chloranyl-1-(2-ethylsulfanylpropyl)-5-phenyl-2,3,4,5-tetrahydro-1,4-benzodiazepine

Systemtic Name: 7-chloranyl-1-(2-ethylsulfanylpropyl)-5-phenyl-2,3,4,5-tetrahydro-1,4-benzodiazepine Openeye Name: 7-chloro-1-(2-ethylsulfanylpropyl)-5-phenyl-2,3,4,5-tetrahydro-1,4-benzodiazepine CAS Name: 7-chloro-1-[2-(ethylthio)propyl]-5-phenyl-2,3,4,5-tetrahydro-1,4-benzodiazepine IUPAC Name: 7-chloro-1-(2-ethylsulfanylpropyl)-5-phenyl-2,3,4,5-tetrahydro-1,4-benzodiazepine Traditional Name: 7-chloro-1-[2-(ethylthio)propyl]-5-phenyl-2,3,4,5-tetrahydro-1,4-benzodiazepine Formula: C20H25ClN2S MolecularWeight: 360.9439

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C)CN1CCNC(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CCSC(C)CN1CCNC(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H25ClN2S/c1-3-24-15(2)14-23-12-11-22-20(16-7-5-4-6-8-16)18-13-17(21)9-10-19(18)23/h4-10,13,15,20,22H,3,11-12,14H2,1-2H3