N-(3,4-dipropoxyphenyl)-2-(4-methylphenyl)sulfanyl-5-nitro-benzamide

Systemtic Name: N-(3,4-dipropoxyphenyl)-2-(4-methylphenyl)sulfanyl-5-nitro-benzamide Openeye Name: N-(3,4-dipropoxyphenyl)-5-nitro-2-(p-tolylsulfanyl)benzamide CAS Name: N-(3,4-dipropoxyphenyl)-2-[(4-methylphenyl)thio]-5-nitrobenzamide IUPAC Name: N-(3,4-dipropoxyphenyl)-2-(4-methylphenyl)sulfanyl-5-nitrobenzamide Traditional Name: N-(3,4-dipropoxyphenyl)-5-nitro-2-(p-tolylthio)benzamide Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=C(C=C3)C)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=C(C=C3)C)OCCC

InChI

InChI=1S/C26H28N2O5S/c1-4-14-32-23-12-8-19(16-24(23)33-15-5-2)27-26(29)22-17-20(28(30)31)9-13-25(22)34-21-10-6-18(3)7-11-21/h6-13,16-17H,4-5,14-15H2,1-3H3,(H,27,29)