3-chloranyl-N-[(E)-1-[4-(thiophen-2-ylcarbonylamino)phenyl]ethylideneamino]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(E)-1-[4-(thiophen-2-ylcarbonylamino)phenyl]ethylideneamino]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(E)-1-[4-(thiophene-2-carbonylamino)phenyl]ethylideneamino]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(E)-1-[4-[[oxo(thiophen-2-yl)methyl]amino]phenyl]ethylideneamino]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(E)-1-[4-(thiophene-2-carbonylamino)phenyl]ethylideneamino]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(E)-1-[4-(2-thenoylamino)phenyl]ethylideneamino]benzothiophene-2-carboxamide Formula: C22H16ClN3O2S2 MolecularWeight: 453.96434

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=C(C2=CC=CC=C2S1)Cl)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C/C(=N\NC(=O)C1=C(C2=CC=CC=C2S1)Cl)/C3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H16ClN3O2S2/c1-13(14-8-10-15(11-9-14)24-21(27)18-7-4-12-29-18)25-26-22(28)20-19(23)16-5-2-3-6-17(16)30-20/h2-12H,1H3,(H,24,27)(H,26,28)/b25-13+