N-[2-methyl-4-[[3-methyl-5-propan-2-yl-4-(2-pyridin-2-ylsulfanylethanoylamino)phenyl]methyl]-6-propan-2-yl-phenyl]-2-pyridin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[2-methyl-4-[[3-methyl-5-propan-2-yl-4-(2-pyridin-2-ylsulfanylethanoylamino)phenyl]methyl]-6-propan-2-yl-phenyl]-2-pyridin-2-ylsulfanyl-ethanamide Openeye Name: N-[2-isopropyl-4-[[3-isopropyl-5-methyl-4-[[2-(2-pyridylsulfanyl)acetyl]amino]phenyl]methyl]-6-methyl-phenyl]-2-(2-pyridylsulfanyl)acetamide CAS Name: N-[2-methyl-4-[[3-methyl-4-[[1-oxo-2-(2-pyridinylthio)ethyl]amino]-5-propan-2-ylphenyl]methyl]-6-propan-2-ylphenyl]-2-(2-pyridinylthio)acetamide IUPAC Name: N-[2-methyl-4-[[3-methyl-5-propan-2-yl-4-[(2-pyridin-2-ylsulfanylacetyl)amino]phenyl]methyl]-6-propan-2-ylphenyl]-2-pyridin-2-ylsulfanylacetamide Traditional Name: N-[2-isopropyl-4-[3-isopropyl-5-methyl-4-[[2-(2-pyridylthio)acetyl]amino]benzyl]-6-methyl-phenyl]-2-(2-pyridylthio)acetamide Formula: C35H40N4O2S2 MolecularWeight: 612.8477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CC2=CC(=C(C(=C2)C(C)C)NC(=O)CSC3=CC=CC=N3)C)C(C)C)NC(=O)CSC4=CC=CC=N4

Isomeric SMILES

CC1=C(C(=CC(=C1)CC2=CC(=C(C(=C2)C(C)C)NC(=O)CSC3=CC=CC=N3)C)C(C)C)NC(=O)CSC4=CC=CC=N4

InChI

InChI=1S/C35H40N4O2S2/c1-22(2)28-18-26(15-24(5)34(28)38-30(40)20-42-32-11-7-9-13-36-32)17-27-16-25(6)35(29(19-27)23(3)4)39-31(41)21-43-33-12-8-10-14-37-33/h7-16,18-19,22-23H,17,20-21H2,1-6H3,(H,38,40)(H,39,41)