N-(2-methylsulfanylethyl)-3-(3-nitro-1,2,4-triazol-1-yl)propanamide

Systemtic Name: N-(2-methylsulfanylethyl)-3-(3-nitro-1,2,4-triazol-1-yl)propanamide Openeye Name: N-(2-methylsulfanylethyl)-3-(3-nitro-1,2,4-triazol-1-yl)propanamide CAS Name: N-[2-(methylthio)ethyl]-3-(3-nitro-1,2,4-triazol-1-yl)propanamide IUPAC Name: N-(2-methylsulfanylethyl)-3-(3-nitro-1,2,4-triazol-1-yl)propanamide Traditional Name: N-[2-(methylthio)ethyl]-3-(3-nitro-1,2,4-triazol-1-yl)propionamide Formula: C8H13N5O3S MolecularWeight: 259.28552

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Descriptors Computed from Structure

Canonical SMILES:

CSCCNC(=O)CCN1C=NC(=N1)[N+](=O)[O-]

Isomeric SMILES

CSCCNC(=O)CCN1C=NC(=N1)[N+](=O)[O-]

InChI

InChI=1S/C8H13N5O3S/c1-17-5-3-9-7(14)2-4-12-6-10-8(11-12)13(15)16/h6H,2-5H2,1H3,(H,9,14)