2-[[5-(5-chloranyl-2-nitro-phenyl)furan-2-yl]methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

Systemtic Name: 2-[[5-(5-chloranyl-2-nitro-phenyl)furan-2-yl]methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Openeye Name: 2-[[5-(5-chloro-2-nitro-phenyl)-2-furyl]methyleneamino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile CAS Name: 2-[[5-(5-chloro-2-nitrophenyl)-2-furanyl]methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile IUPAC Name: 2-[[5-(5-chloro-2-nitrophenyl)furan-2-yl]methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Traditional Name: 2-[[5-(5-chloro-2-nitro-phenyl)-2-furyl]methyleneamino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile Formula: C20H14ClN3O3S MolecularWeight: 411.86146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)N=CC3=CC=C(O3)C4=C(C=CC(=C4)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)N=CC3=CC=C(O3)C4=C(C=CC(=C4)Cl)[N+](=O)[O-])C#N

InChI

InChI=1S/C20H14ClN3O3S/c21-12-5-7-17(24(25)26)15(9-12)18-8-6-13(27-18)11-23-20-16(10-22)14-3-1-2-4-19(14)28-20/h5-9,11H,1-4H2