N-[[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[[3-methoxy-4-(p-tolylmethoxy)phenyl]methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[[3-methoxy-4-(4-methylbenzyl)oxy-benzylidene]amino]-5-nitro-benzothiophene-2-carboxamide Formula: C25H21N3O5S MolecularWeight: 475.51634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C25H21N3O5S/c1-16-3-5-17(6-4-16)15-33-21-9-7-18(11-22(21)32-2)14-26-27-25(29)24-13-19-12-20(28(30)31)8-10-23(19)34-24/h3-14H,15H2,1-2H3,(H,27,29)