2-phenyl-3-(2H-1,2,3,4-tetrazol-5-ylmethylsulfanyl)-1H-indole

Systemtic Name: 2-phenyl-3-(2H-1,2,3,4-tetrazol-5-ylmethylsulfanyl)-1H-indole Openeye Name: 2-phenyl-3-(2H-tetrazol-5-ylmethylsulfanyl)-1H-indole CAS Name: 2-phenyl-3-(2H-tetrazol-5-ylmethylthio)-1H-indole IUPAC Name: 2-phenyl-3-(2H-tetrazol-5-ylmethylsulfanyl)-1H-indole Traditional Name: 2-phenyl-3-(2H-tetrazol-5-ylmethylthio)-1H-indole Formula: C16H13N5S MolecularWeight: 307.37292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)SCC4=NNN=N4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)SCC4=NNN=N4

InChI

InChI=1S/C16H13N5S/c1-2-6-11(7-3-1)15-16(22-10-14-18-20-21-19-14)12-8-4-5-9-13(12)17-15/h1-9,17H,10H2,(H,18,19,20,21)