N-(cycloheptylideneamino)-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(cycloheptylideneamino)-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(cycloheptylideneamino)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(cycloheptylideneamino)-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(cycloheptylideneamino)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(cycloheptylideneamino)-2-(2-pyrimidylthio)acetamide Formula: C13H18N4OS MolecularWeight: 278.37322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(=NNC(=O)CSC2=NC=CC=N2)CC1

Isomeric SMILES

C1CCCC(=NNC(=O)CSC2=NC=CC=N2)CC1

InChI

InChI=1S/C13H18N4OS/c18-12(10-19-13-14-8-5-9-15-13)17-16-11-6-3-1-2-4-7-11/h5,8-9H,1-4,6-7,10H2,(H,17,18)