4-[(3-chloranyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-3-sulfanylidene-2H-1,2,4-triazin-5-one

Systemtic Name: 4-[(3-chloranyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-3-sulfanylidene-2H-1,2,4-triazin-5-one Openeye Name: 4-[(3-chloro-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-3-thioxo-2H-1,2,4-triazin-5-one CAS Name: 4-[(3-chloro-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-6-methyl-3-sulfanylidene-2H-1,2,4-triazin-5-one IUPAC Name: 4-[(3-chloro-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-3-sulfanylidene-2H-1,2,4-triazin-5-one Traditional Name: 4-[(3-chloro-6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-3-thioxo-2H-1,2,4-triazin-5-one Formula: C11H8ClN5O4S MolecularWeight: 341.73032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N(C1=O)NC=C2C=C(C=C(C2=O)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=NNC(=S)N(C1=O)NC=C2C=C(C=C(C2=O)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H8ClN5O4S/c1-5-10(19)16(11(22)15-14-5)13-4-6-2-7(12)3-8(9(6)18)17(20)21/h2-4,13H,1H3,(H,15,22)