5-(5-butylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)-2,3-dimethyl-1H-indole

Systemtic Name: 5-(5-butylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)-2,3-dimethyl-1H-indole Openeye Name: 5-(5-butylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)-2,3-dimethyl-1H-indole CAS Name: 5-[5-(butylthio)-4-phenyl-1,2,4-triazol-3-yl]-2,3-dimethyl-1H-indole IUPAC Name: 5-(5-butylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)-2,3-dimethyl-1H-indole Traditional Name: 5-[5-(butylthio)-4-phenyl-1,2,4-triazol-3-yl]-2,3-dimethyl-1H-indole Formula: C22H24N4S MolecularWeight: 376.51776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(N1C2=CC=CC=C2)C3=CC4=C(C=C3)NC(=C4C)C

Isomeric SMILES

CCCCSC1=NN=C(N1C2=CC=CC=C2)C3=CC4=C(C=C3)NC(=C4C)C

InChI

InChI=1S/C22H24N4S/c1-4-5-13-27-22-25-24-21(26(22)18-9-7-6-8-10-18)17-11-12-20-19(14-17)15(2)16(3)23-20/h6-12,14,23H,4-5,13H2,1-3H3