N,N-bis(2-methylpropyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide

Systemtic Name: N,N-bis(2-methylpropyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide Openeye Name: N,N-diisobutyl-2-(1H-perimidin-2-ylsulfanyl)acetamide CAS Name: N,N-bis(2-methylpropyl)-2-(1H-perimidin-2-ylthio)acetamide IUPAC Name: N,N-bis(2-methylpropyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide Traditional Name: N,N-diisobutyl-2-(1H-perimidin-2-ylthio)acetamide Formula: C21H27N3OS MolecularWeight: 369.52358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C(=O)CSC1=NC2=CC=CC3=C2C(=CC=C3)N1

Isomeric SMILES

CC(C)CN(CC(C)C)C(=O)CSC1=NC2=CC=CC3=C2C(=CC=C3)N1

InChI

InChI=1S/C21H27N3OS/c1-14(2)11-24(12-15(3)4)19(25)13-26-21-22-17-9-5-7-16-8-6-10-18(23-21)20(16)17/h5-10,14-15H,11-13H2,1-4H3,(H,22,23)