N-[3-[2-[(5-bromanyl-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-3-oxidanylidene-1-thiophen-2-yl-prop-1-en-2-yl]benzamide

Systemtic Name: N-[3-[2-[(5-bromanyl-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-3-oxidanylidene-1-thiophen-2-yl-prop-1-en-2-yl]benzamide Openeye Name: N-[1-[[(5-bromo-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]-2-(2-thienyl)vinyl]benzamide CAS Name: N-[3-[(5-bromo-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylhydrazo]-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]benzamide IUPAC Name: N-[3-[2-[(5-bromo-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]benzamide Traditional Name: N-[1-[[(5-bromo-6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]-2-(2-thienyl)vinyl]benzamide Formula: C21H15BrN4O5S MolecularWeight: 515.3366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=CC2=CC=CS2)C(=O)NNC=C3C=C(C=C(C3=O)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=CC2=CC=CS2)C(=O)NNC=C3C=C(C=C(C3=O)Br)[N+](=O)[O-]

InChI

InChI=1S/C21H15BrN4O5S/c22-17-10-15(26(30)31)9-14(19(17)27)12-23-25-21(29)18(11-16-7-4-8-32-16)24-20(28)13-5-2-1-3-6-13/h1-12,23H,(H,24,28)(H,25,29)