diethyl-[2-[(4-phenyl-5-phenylazanyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]azanium

Systemtic Name: diethyl-[2-[(4-phenyl-5-phenylazanyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]azanium Openeye Name: 2-[(5-anilino-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethyl-diethyl-ammonium CAS Name: 2-[(5-anilino-4-phenyl-1,2,4-triazol-3-yl)thio]ethyl-diethylammonium IUPAC Name: 2-[(5-anilino-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethyl-diethylazanium Traditional Name: 2-[(5-anilino-4-phenyl-1,2,4-triazol-3-yl)thio]ethyl-diethyl-ammonium Formula: C20H26N5S+ MolecularWeight: 368.51894

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCSC1=NN=C(N1C2=CC=CC=C2)NC3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)CCSC1=NN=C(N1C2=CC=CC=C2)NC3=CC=CC=C3

InChI

InChI=1S/C20H25N5S/c1-3-24(4-2)15-16-26-20-23-22-19(21-17-11-7-5-8-12-17)25(20)18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3,(H,21,22)/p+1