3-chloranyl-N-[(Z)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(Z)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(Z)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methyleneamino]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(Z)-[4-methoxy-3-[(4-nitro-1-pyrazolyl)methyl]phenyl]methylideneamino]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(Z)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(Z)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]benzylidene]amino]benzothiophene-2-carboxamide Formula: C21H16ClN5O4S MolecularWeight: 469.90084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C2=C(C3=CC=CC=C3S2)Cl)CN4C=C(C=N4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N\NC(=O)C2=C(C3=CC=CC=C3S2)Cl)CN4C=C(C=N4)[N+](=O)[O-]

InChI

InChI=1S/C21H16ClN5O4S/c1-31-17-7-6-13(8-14(17)11-26-12-15(10-24-26)27(29)30)9-23-25-21(28)20-19(22)16-4-2-3-5-18(16)32-20/h2-10,12H,11H2,1H3,(H,25,28)/b23-9-