4-[[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-6-methyl-3-sulfanylidene-2H-1,2,4-triazin-5-one

Systemtic Name: 4-[[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-6-methyl-3-sulfanylidene-2H-1,2,4-triazin-5-one Openeye Name: 4-[[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-6-methyl-3-thioxo-2H-1,2,4-triazin-5-one CAS Name: 4-[[1-(4-iodophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-6-methyl-3-sulfanylidene-2H-1,2,4-triazin-5-one IUPAC Name: 4-[[1-(4-iodophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-6-methyl-3-sulfanylidene-2H-1,2,4-triazin-5-one Traditional Name: 4-[[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-6-methyl-3-thioxo-2H-1,2,4-triazin-5-one Formula: C17H16IN5OS MolecularWeight: 465.31131

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)I)C)C=NN3C(=O)C(=NNC3=S)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)I)C)C=NN3C(=O)C(=NNC3=S)C

InChI

InChI=1S/C17H16IN5OS/c1-10-8-13(9-19-23-16(24)11(2)20-21-17(23)25)12(3)22(10)15-6-4-14(18)5-7-15/h4-9H,1-3H3,(H,21,25)