4-[(4-methylphenyl)-oxidanyl-amino]-6-sulfanylidene-1,2-dihydro-1,2,5-triazepine-3,7-dione

Systemtic Name: 4-[(4-methylphenyl)-oxidanyl-amino]-6-sulfanylidene-1,2-dihydro-1,2,5-triazepine-3,7-dione Openeye Name: 4-(N-hydroxy-4-methyl-anilino)-6-thioxo-1,2-dihydro-1,2,5-triazepine-3,7-dione CAS Name: 4-(N-hydroxy-4-methylanilino)-6-sulfanylidene-1,2-dihydro-1,2,5-triazepine-3,7-dione IUPAC Name: 4-(N-hydroxy-4-methylanilino)-6-sulfanylidene-1,2-dihydro-1,2,5-triazepine-3,7-dione Traditional Name: 4-(N-hydroxy-4-methyl-anilino)-6-thioxo-1,2-dihydro-1,2,5-triazepine-3,7-quinone Formula: C11H10N4O3S MolecularWeight: 278.2871

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C2=NC(=S)C(=O)NNC2=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N(C2=NC(=S)C(=O)NNC2=O)O

InChI

InChI=1S/C11H10N4O3S/c1-6-2-4-7(5-3-6)15(18)8-9(16)13-14-10(17)11(19)12-8/h2-5,18H,1H3,(H,13,16)(H,12,14,17,19)