2-(1-azanylbutyl)-N-[2-(phenylmethylsulfanyl)ethyl]-1,3-oxazole-4-carboxamide

Systemtic Name: 2-(1-azanylbutyl)-N-[2-(phenylmethylsulfanyl)ethyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-(1-aminobutyl)-N-(2-benzylsulfanylethyl)oxazole-4-carboxamide CAS Name: 2-(1-aminobutyl)-N-[2-(phenylmethylthio)ethyl]-4-oxazolecarboxamide IUPAC Name: 2-(1-aminobutyl)-N-(2-benzylsulfanylethyl)-1,3-oxazole-4-carboxamide Traditional Name: 2-(1-aminobutyl)-N-[2-(benzylthio)ethyl]oxazole-4-carboxamide Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=NC(=CO1)C(=O)NCCSCC2=CC=CC=C2)N

Isomeric SMILES

CCCC(C1=NC(=CO1)C(=O)NCCSCC2=CC=CC=C2)N

InChI

InChI=1S/C17H23N3O2S/c1-2-6-14(18)17-20-15(11-22-17)16(21)19-9-10-23-12-13-7-4-3-5-8-13/h3-5,7-8,11,14H,2,6,9-10,12,18H2,1H3,(H,19,21)