3-chloranyl-N-[(E)-[1-(4-nitrophenyl)pyrrol-2-yl]methylideneamino]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(E)-[1-(4-nitrophenyl)pyrrol-2-yl]methylideneamino]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(E)-[1-(4-nitrophenyl)pyrrol-2-yl]methyleneamino]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(E)-[1-(4-nitrophenyl)-2-pyrrolyl]methylideneamino]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(E)-[1-(4-nitrophenyl)pyrrol-2-yl]methylideneamino]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(E)-[1-(4-nitrophenyl)pyrrol-2-yl]methyleneamino]benzothiophene-2-carboxamide Formula: C20H13ClN4O3S MolecularWeight: 424.86022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NN=CC3=CC=CN3C4=CC=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)N/N=C/C3=CC=CN3C4=CC=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H13ClN4O3S/c21-18-16-5-1-2-6-17(16)29-19(18)20(26)23-22-12-15-4-3-11-24(15)13-7-9-14(10-8-13)25(27)28/h1-12H,(H,23,26)/b22-12+