1-(1H-indol-3-yl)-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanone

Systemtic Name: 1-(1H-indol-3-yl)-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanone Openeye Name: 1-(1H-indol-3-yl)-2-[[4-isopropyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanone CAS Name: 1-(1H-indol-3-yl)-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]thio]-2-phenylethanone IUPAC Name: 1-(1H-indol-3-yl)-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-2-phenylethanone Traditional Name: 1-(1H-indol-3-yl)-2-[[4-isopropyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-2-phenyl-ethanone Formula: C28H26N4O2S MolecularWeight: 482.59664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=C1SC(C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43)C5=CC=C(C=C5)OC

Isomeric SMILES

CC(C)N1C(=NN=C1SC(C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43)C5=CC=C(C=C5)OC

InChI

InChI=1S/C28H26N4O2S/c1-18(2)32-27(20-13-15-21(34-3)16-14-20)30-31-28(32)35-26(19-9-5-4-6-10-19)25(33)23-17-29-24-12-8-7-11-22(23)24/h4-18,26,29H,1-3H3