ethyl N-[2-(1H-perimidin-2-ylsulfanyl)ethanoyl]carbamate

Systemtic Name: ethyl N-[2-(1H-perimidin-2-ylsulfanyl)ethanoyl]carbamate Openeye Name: ethyl N-[2-(1H-perimidin-2-ylsulfanyl)acetyl]carbamate CAS Name: N-[1-oxo-2-(1H-perimidin-2-ylthio)ethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-(1H-perimidin-2-ylsulfanyl)acetyl]carbamate Traditional Name: N-[2-(1H-perimidin-2-ylthio)acetyl]carbamic acid ethyl ester Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O3S/c1-2-22-16(21)19-13(20)9-23-15-17-11-7-3-5-10-6-4-8-12(18-15)14(10)11/h3-8H,2,9H2,1H3,(H,17,18)(H,19,20,21)