N-[[4-(4-chlorophenyl)sulfanylphenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[4-(4-chlorophenyl)sulfanylphenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[[4-(4-chlorophenyl)sulfanylphenyl]methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[[4-[(4-chlorophenyl)thio]phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[4-(4-chlorophenyl)sulfanylphenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[[4-[(4-chlorophenyl)thio]benzylidene]amino]-5-nitro-benzothiophene-2-carboxamide Formula: C22H14ClN3O3S2 MolecularWeight: 467.94786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC(=CC=C1C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H14ClN3O3S2/c23-16-3-8-19(9-4-16)30-18-6-1-14(2-7-18)13-24-25-22(27)21-12-15-11-17(26(28)29)5-10-20(15)31-21/h1-13H,(H,25,27)