S-butyl 3-methyl-4-oxidanylidene-imidazo[5,1-d][1,2,3,5]tetrazine-8-carbothioate

Systemtic Name: S-butyl 3-methyl-4-oxidanylidene-imidazo[5,1-d][1,2,3,5]tetrazine-8-carbothioate Openeye Name: S-butyl 3-methyl-4-oxo-imidazo[5,1-d][1,2,3,5]tetrazine-8-carbothioate CAS Name: 3-methyl-4-oxo-8-imidazo[5,1-d][1,2,3,5]tetrazinecarbothioic acid S-butyl ester IUPAC Name: S-butyl 3-methyl-4-oxoimidazo[5,1-d][1,2,3,5]tetrazine-8-carbothioate Traditional Name: 4-keto-3-methyl-imidazo[5,1-d][1,2,3,5]tetrazine-8-carbothioic acid S-butyl ester Formula: C10H13N5O2S MolecularWeight: 267.30752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(=O)C1=C2N=NN(C(=O)N2C=N1)C

Isomeric SMILES

CCCCSC(=O)C1=C2N=NN(C(=O)N2C=N1)C

InChI

InChI=1S/C10H13N5O2S/c1-3-4-5-18-9(16)7-8-12-13-14(2)10(17)15(8)6-11-7/h6H,3-5H2,1-2H3