N-[2-[[(3-bromanyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[[(3-bromanyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[2-[[(3-bromo-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[2-[[(3-bromo-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylhydrazo]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[[(3-bromo-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-[[(3-bromo-6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]thiophene-2-carboxamide Formula: C19H13BrN4O5S MolecularWeight: 489.29932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NNC=C2C=C(C=C(C2=O)[N+](=O)[O-])Br)NC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NNC=C2C=C(C=C(C2=O)[N+](=O)[O-])Br)NC(=O)C3=CC=CS3

InChI

InChI=1S/C19H13BrN4O5S/c20-12-8-11(17(25)15(9-12)24(28)29)10-21-23-18(26)13-4-1-2-5-14(13)22-19(27)16-6-3-7-30-16/h1-10,21H,(H,22,27)(H,23,26)