1-(1H-indol-3-yl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanone

Systemtic Name: 1-(1H-indol-3-yl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanone Openeye Name: 1-(1H-indol-3-yl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanone CAS Name: 1-(1H-indol-3-yl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]thio]-2-phenylethanone IUPAC Name: 1-(1H-indol-3-yl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenylethanone Traditional Name: 1-(1H-indol-3-yl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]thio]-2-phenyl-ethanone Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=NN=C1SC(C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

COCCN1C=NN=C1SC(C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H20N4O2S/c1-27-12-11-25-14-23-24-21(25)28-20(15-7-3-2-4-8-15)19(26)17-13-22-18-10-6-5-9-16(17)18/h2-10,13-14,20,22H,11-12H2,1H3