2-[(7-chloranyl-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-2-yl)sulfanyl]ethanol

Systemtic Name: 2-[(7-chloranyl-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-2-yl)sulfanyl]ethanol Openeye Name: 2-[(7-chloro-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-2-yl)sulfanyl]ethanol CAS Name: 2-[(7-chloro-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-2-yl)thio]ethanol IUPAC Name: 2-[(7-chloro-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-2-yl)sulfanyl]ethanol Traditional Name: 2-[(7-chloro-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-2-yl)thio]ethanol Formula: C17H17ClN2OS MolecularWeight: 332.84768

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)SCCO

Isomeric SMILES

C1C(NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)SCCO

InChI

InChI=1S/C17H17ClN2OS/c18-13-6-7-15-14(10-13)17(12-4-2-1-3-5-12)19-11-16(20-15)22-9-8-21/h1-7,10,16,20-21H,8-9,11H2