2-[(4-methoxy-3-nitro-phenyl)methylideneamino]-N-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[(4-methoxy-3-nitro-phenyl)methylideneamino]-N-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-benzyl-2-[(4-methoxy-3-nitro-phenyl)methyleneamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[(4-methoxy-3-nitrophenyl)methylideneamino]-N-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-benzyl-2-[(4-methoxy-3-nitrophenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-benzyl-2-[(4-methoxy-3-nitro-benzylidene)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NC2=C(C3=C(S2)CCCC3)C(=O)NCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C=NC2=C(C3=C(S2)CCCC3)C(=O)NCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H23N3O4S/c1-31-20-12-11-17(13-19(20)27(29)30)15-26-24-22(18-9-5-6-10-21(18)32-24)23(28)25-14-16-7-3-2-4-8-16/h2-4,7-8,11-13,15H,5-6,9-10,14H2,1H3,(H,25,28)