2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-tetralin-6-yl-ethanone CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-1-tetralin-6-yl-ethanone Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)C(=O)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)C(=O)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C16H18N4OS/c17-14-8-15(18)20-16(19-14)22-9-13(21)12-6-5-10-3-1-2-4-11(10)7-12/h5-8H,1-4,9H2,(H4,17,18,19,20)