N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[2-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-2-oxidanylidene-ethanamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[2-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-2-oxidanylidene-ethanamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[2-[(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazino]-2-oxo-acetamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylhydrazo]-2-oxoacetamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[2-[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-2-oxoacetamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-keto-2-[N'-[(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazino]acetamide Formula: C18H15N5O5S MolecularWeight: 413.4072

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C(=O)NNC=C3C=C(C=CC3=O)[N+](=O)[O-])C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C(=O)NNC=C3C=C(C=CC3=O)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H15N5O5S/c19-8-13-12-3-1-2-4-15(12)29-18(13)21-16(25)17(26)22-20-9-10-7-11(23(27)28)5-6-14(10)24/h5-7,9,20H,1-4H2,(H,21,25)(H,22,26)