N-(tert-butylcarbamoyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide

Systemtic Name: N-(tert-butylcarbamoyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide Openeye Name: N-(tert-butylcarbamoyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide CAS Name: N-[(tert-butylamino)-oxomethyl]-2-(1H-perimidin-2-ylthio)acetamide IUPAC Name: N-(tert-butylcarbamoyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide Traditional Name: N-(tert-butylcarbamoyl)-2-(1H-perimidin-2-ylthio)acetamide Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N4O2S/c1-18(2,3)22-16(24)21-14(23)10-25-17-19-12-8-4-6-11-7-5-9-13(20-17)15(11)12/h4-9H,10H2,1-3H3,(H,19,20)(H2,21,22,23,24)