5-bromanyl-3-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-ylsulfanyl)-1H-indole

Systemtic Name: 5-bromanyl-3-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-ylsulfanyl)-1H-indole Openeye Name: 5-bromo-3-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-ylsulfanyl)-1H-indole CAS Name: 5-bromo-3-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-ylthio)-1H-indole IUPAC Name: 5-bromo-3-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-ylsulfanyl)-1H-indole Traditional Name: 5-bromo-3-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-ylthio)-1H-indole Formula: C13H14BrN3S MolecularWeight: 324.23936

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN=C(NC1)SC2=CNC3=C2C=C(C=C3)Br

Isomeric SMILES

C1CCN=C(NC1)SC2=CNC3=C2C=C(C=C3)Br

InChI

InChI=1S/C13H14BrN3S/c14-9-3-4-11-10(7-9)12(8-17-11)18-13-15-5-1-2-6-16-13/h3-4,7-8,17H,1-2,5-6H2,(H,15,16)