2-(1-azanyl-3-methylsulfanyl-propyl)-N-(2-oxidanylideneazepan-3-yl)-1,3-oxazole-4-carboxamide

Systemtic Name: 2-(1-azanyl-3-methylsulfanyl-propyl)-N-(2-oxidanylideneazepan-3-yl)-1,3-oxazole-4-carboxamide Openeye Name: 2-(1-amino-3-methylsulfanyl-propyl)-N-(2-oxoazepan-3-yl)oxazole-4-carboxamide CAS Name: 2-[1-amino-3-(methylthio)propyl]-N-(2-oxo-3-azepanyl)-4-oxazolecarboxamide IUPAC Name: 2-(1-amino-3-methylsulfanylpropyl)-N-(2-oxoazepan-3-yl)-1,3-oxazole-4-carboxamide Traditional Name: 2-[1-amino-3-(methylthio)propyl]-N-(2-ketoazepan-3-yl)oxazole-4-carboxamide Formula: C14H22N4O3S MolecularWeight: 326.41448

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC(=CO1)C(=O)NC2CCCCNC2=O)N

Isomeric SMILES

CSCCC(C1=NC(=CO1)C(=O)NC2CCCCNC2=O)N

InChI

InChI=1S/C14H22N4O3S/c1-22-7-5-9(15)14-18-11(8-21-14)13(20)17-10-4-2-3-6-16-12(10)19/h8-10H,2-7,15H2,1H3,(H,16,19)(H,17,20)