2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: 2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-N-(furan-2-ylmethyl)ethanamide Openeye Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-N-(2-furylmethyl)acetamide CAS Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylthio]-N-(2-furanylmethyl)acetamide IUPAC Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-[(4-amino-6-anilino-s-triazin-2-yl)methylthio]-N-(2-furfuryl)acetamide Formula: C17H18N6O2S MolecularWeight: 370.42882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSCC(=O)NCC3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C17H18N6O2S/c18-16-21-14(22-17(23-16)20-12-5-2-1-3-6-12)10-26-11-15(24)19-9-13-7-4-8-25-13/h1-8H,9-11H2,(H,19,24)(H3,18,20,21,22,23)