N-(5-methyl-1,2-oxazol-3-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]butanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]butanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[(1-phenyltetrazol-5-yl)methylsulfanyl]butanamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[(1-phenyl-5-tetrazolyl)methylthio]butanamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[(1-phenyltetrazol-5-yl)methylsulfanyl]butanamide Traditional Name: N-(5-methylisoxazol-3-yl)-2-[(1-phenyltetrazol-5-yl)methylthio]butyramide Formula: C16H18N6O2S MolecularWeight: 358.41812

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NOC(=C1)C)SCC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NC1=NOC(=C1)C)SCC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C16H18N6O2S/c1-3-13(16(23)17-14-9-11(2)24-19-14)25-10-15-18-20-21-22(15)12-7-5-4-6-8-12/h4-9,13H,3,10H2,1-2H3,(H,17,19,23)