5-methyl-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-4-nitro-thiophene-2-carboxamide

Systemtic Name: 5-methyl-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-4-nitro-thiophene-2-carboxamide Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-5-methyl-4-nitro-thiophene-2-carboxamide CAS Name: 5-methyl-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]-4-nitro-2-thiophenecarboxamide IUPAC Name: 5-methyl-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-4-nitrothiophene-2-carboxamide Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-5-methyl-4-nitro-thiophene-2-carboxamide Formula: C15H14N6O3S3 MolecularWeight: 422.50506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC(=C(S2)C)[N+](=O)[O-])C3=NNC(=S)N3CC=C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC(=C(S2)C)[N+](=O)[O-])C3=NNC(=S)N3CC=C

InChI

InChI=1S/C15H14N6O3S3/c1-4-5-20-12(18-19-15(20)25)11-7(2)16-14(27-11)17-13(22)10-6-9(21(23)24)8(3)26-10/h4,6H,1,5H2,2-3H3,(H,19,25)(H,16,17,22)