N-[4,5-dimethyl-3-[(4-methylsulfanylphenyl)-(pyridin-2-ylamino)methyl]thiophen-2-yl]benzamide

Systemtic Name: N-[4,5-dimethyl-3-[(4-methylsulfanylphenyl)-(pyridin-2-ylamino)methyl]thiophen-2-yl]benzamide Openeye Name: N-[4,5-dimethyl-3-[(4-methylsulfanylphenyl)-(2-pyridylamino)methyl]-2-thienyl]benzamide CAS Name: N-[4,5-dimethyl-3-[[4-(methylthio)phenyl]-(2-pyridinylamino)methyl]-2-thiophenyl]benzamide IUPAC Name: N-[4,5-dimethyl-3-[(4-methylsulfanylphenyl)-(pyridin-2-ylamino)methyl]thiophen-2-yl]benzamide Traditional Name: N-[4,5-dimethyl-3-[[4-(methylthio)phenyl]-(2-pyridylamino)methyl]-2-thienyl]benzamide Formula: C26H25N3OS2 MolecularWeight: 459.6262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(C2=CC=C(C=C2)SC)NC3=CC=CC=N3)NC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1C(C2=CC=C(C=C2)SC)NC3=CC=CC=N3)NC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C26H25N3OS2/c1-17-18(2)32-26(29-25(30)20-9-5-4-6-10-20)23(17)24(28-22-11-7-8-16-27-22)19-12-14-21(31-3)15-13-19/h4-16,24H,1-3H3,(H,27,28)(H,29,30)