S-(2-acetamidoethyl) (E)-2-methyl-3-(2H-1,2,3,4-tetrazol-5-yl)prop-2-enethioate

Systemtic Name: S-(2-acetamidoethyl) (E)-2-methyl-3-(2H-1,2,3,4-tetrazol-5-yl)prop-2-enethioate Openeye Name: S-(2-acetamidoethyl) (E)-2-methyl-3-(2H-tetrazol-5-yl)prop-2-enethioate CAS Name: (E)-2-methyl-3-(2H-tetrazol-5-yl)-2-propenethioic acid S-(2-acetamidoethyl) ester IUPAC Name: S-(2-acetamidoethyl) (E)-2-methyl-3-(2H-tetrazol-5-yl)prop-2-enethioate Traditional Name: (E)-2-methyl-3-(2H-tetrazol-5-yl)prop-2-enethioic acid S-(2-acetamidoethyl) ester Formula: C9H13N5O2S MolecularWeight: 255.29682

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=NNN=N1)C(=O)SCCNC(=O)C

Isomeric SMILES

C/C(=C\C1=NNN=N1)/C(=O)SCCNC(=O)C

InChI

InChI=1S/C9H13N5O2S/c1-6(5-8-11-13-14-12-8)9(16)17-4-3-10-7(2)15/h5H,3-4H2,1-2H3,(H,10,15)(H,11,12,13,14)/b6-5+