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

Systemtic Name: N-(3,4-dipropoxyphenyl)-4-(4-methylphenyl)sulfanyl-3-nitro-benzamide Openeye Name: N-(3,4-dipropoxyphenyl)-3-nitro-4-(p-tolylsulfanyl)benzamide CAS Name: N-(3,4-dipropoxyphenyl)-4-[(4-methylphenyl)thio]-3-nitrobenzamide IUPAC Name: N-(3,4-dipropoxyphenyl)-4-(4-methylphenyl)sulfanyl-3-nitrobenzamide Traditional Name: N-(3,4-dipropoxyphenyl)-3-nitro-4-(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=CC(=C(C=C2)SC3=CC=C(C=C3)C)[N+](=O)[O-])OCCC

Isomeric SMILES

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

InChI

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