4-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanylmethyl]benzamide

Systemtic Name: 4-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanylmethyl]benzamide Openeye Name: 4-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanylmethyl]benzamide CAS Name: 4-[[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylthio]methyl]benzamide IUPAC Name: 4-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanylmethyl]benzamide Traditional Name: 4-[[(4-amino-6-anilino-s-triazin-2-yl)methylthio]methyl]benzamide Formula: C18H18N6OS MolecularWeight: 366.44012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSCC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSCC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C18H18N6OS/c19-16(25)13-8-6-12(7-9-13)10-26-11-15-22-17(20)24-18(23-15)21-14-4-2-1-3-5-14/h1-9H,10-11H2,(H2,19,25)(H3,20,21,22,23,24)