N-[4-methyl-1-oxidanylidene-1-[[3-oxidanylidene-4-[2-(3-pyridin-2-ylphenyl)ethanoylamino]butan-2-yl]amino]pentan-2-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[4-methyl-1-oxidanylidene-1-[[3-oxidanylidene-4-[2-(3-pyridin-2-ylphenyl)ethanoylamino]butan-2-yl]amino]pentan-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: N-[3-methyl-1-[[1-methyl-2-oxo-3-[[2-[3-(2-pyridyl)phenyl]acetyl]amino]propyl]carbamoyl]butyl]benzothiophene-2-carboxamide CAS Name: N-[4-methyl-1-oxo-1-[[3-oxo-4-[[1-oxo-2-[3-(2-pyridinyl)phenyl]ethyl]amino]butan-2-yl]amino]pentan-2-yl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[4-methyl-1-oxo-1-[[3-oxo-4-[[2-(3-pyridin-2-ylphenyl)acetyl]amino]butan-2-yl]amino]pentan-2-yl]-1-benzothiophene-2-carboxamide Traditional Name: N-[1-[[2-keto-1-methyl-3-[[2-[3-(2-pyridyl)phenyl]acetyl]amino]propyl]carbamoyl]-3-methyl-butyl]benzothiophene-2-carboxamide Formula: C32H34N4O4S MolecularWeight: 570.70176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C)C(=O)CNC(=O)CC1=CC=CC(=C1)C2=CC=CC=N2)NC(=O)C3=CC4=CC=CC=C4S3

Isomeric SMILES

CC(C)CC(C(=O)NC(C)C(=O)CNC(=O)CC1=CC=CC(=C1)C2=CC=CC=N2)NC(=O)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C32H34N4O4S/c1-20(2)15-26(36-32(40)29-18-24-10-4-5-13-28(24)41-29)31(39)35-21(3)27(37)19-34-30(38)17-22-9-8-11-23(16-22)25-12-6-7-14-33-25/h4-14,16,18,20-21,26H,15,17,19H2,1-3H3,(H,34,38)(H,35,39)(H,36,40)